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Benzoxadiazoles

Benzoxadiazoles

Organic heterocyclic compounds that consist of benzene fused with an oxadiazole; oxadiazoles are a five-membered ring with two carbon atoms, one oxygen atom, and two nitrogen atoms.
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1 – 15 of 66 results
1

AABD-SH (=4-Acetamido-7-mercapto-2,1,3-benzoxadiazole) 95.0+%, TCI America™
SDP

CAS: 254973-02-9 Molecular Formula: C8H7N3O2S Molecular Weight (g/mol): 209.223 MDL Number: MFCD04038408 InChI Key: JPARFDNKICYVCE-UHFFFAOYSA-N Synonym: 4-Acetamido-7-mercaptobenzofurazan, 4-Acetamido-7-mercapto-2,1,3-benzoxadiazole PubChem CID: 44630078 IUPAC Name: N-(4-sulfanylidene-1H-2,1,3-benzoxadiazol-7-yl)acetamide SMILES: CC(=O)NC1=C2C(=NON2)C(=S)C=C1

PubChem CID 44630078
CAS 254973-02-9
Molecular Weight (g/mol) 209.223
MDL Number MFCD04038408
SMILES CC(=O)NC1=C2C(=NON2)C(=S)C=C1
Synonym 4-Acetamido-7-mercaptobenzofurazan, 4-Acetamido-7-mercapto-2,1,3-benzoxadiazole
IUPAC Name N-(4-sulfanylidene-1H-2,1,3-benzoxadiazol-7-yl)acetamide
InChI Key JPARFDNKICYVCE-UHFFFAOYSA-N
Molecular Formula C8H7N3O2S
2

(S)-(+)-DBD-APy 98.0+%, TCI America™
SDP

CAS: 143112-50-9 Molecular Formula: C12H17N5O3S Molecular Weight (g/mol): 311.36 MDL Number: MFCD00191378 InChI Key: SZJGHUNJZRXXCA-UHFFFAOYNA-N Synonym: (S)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)benzofurazan, (S)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)-2,1,3-benzoxadiazole PubChem CID: 15682839 IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide SMILES: CN(C)S(=O)(=O)C1=CC=C(N2CCC(N)C2)C2=NON=C12

PubChem CID 15682839
CAS 143112-50-9
Molecular Weight (g/mol) 311.36
MDL Number MFCD00191378
SMILES CN(C)S(=O)(=O)C1=CC=C(N2CCC(N)C2)C2=NON=C12
Synonym (S)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)benzofurazan, (S)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)-2,1,3-benzoxadiazole
IUPAC Name 7-(3-aminopyrrolidin-1-yl)-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide
InChI Key SZJGHUNJZRXXCA-UHFFFAOYNA-N
Molecular Formula C12H17N5O3S
3

(S)-(+)-NBD-Py-NCS 98.0+%, TCI America™
SDP

CAS: 163927-30-8 Molecular Formula: C11H9N5O3S Molecular Weight (g/mol): 291.285 MDL Number: MFCD02093435 InChI Key: CHKCHHTYBXOUKH-ZETCQYMHSA-N Synonym: (S)-(+)-4-(3-Isothiocyanatopyrrolidin-1-yl)-7-nitrobenzofurazan, (S)-(+)-4-(3-Isothiocyanatopyrrolidin-1-yl)-7-nitro-2,1,3-benzoxadiazole PubChem CID: 16218824 IUPAC Name: 7-[(3S)-3-isothiocyanatopyrrolidin-1-yl]-4-nitro-2,1,3-benzoxadiazole SMILES: C1CN(CC1N=C=S)C2=CC=C(C3=NON=C23)[N+](=O)[O-]

PubChem CID 16218824
CAS 163927-30-8
Molecular Weight (g/mol) 291.285
MDL Number MFCD02093435
SMILES C1CN(CC1N=C=S)C2=CC=C(C3=NON=C23)[N+](=O)[O-]
Synonym (S)-(+)-4-(3-Isothiocyanatopyrrolidin-1-yl)-7-nitrobenzofurazan, (S)-(+)-4-(3-Isothiocyanatopyrrolidin-1-yl)-7-nitro-2,1,3-benzoxadiazole
IUPAC Name 7-[(3S)-3-isothiocyanatopyrrolidin-1-yl]-4-nitro-2,1,3-benzoxadiazole
InChI Key CHKCHHTYBXOUKH-ZETCQYMHSA-N
Molecular Formula C11H9N5O3S
4

NBD-Cl (=4-Chloro-7-nitro-2,1,3-benzoxadiazole) 98.0+%, TCI America™
SDP

CAS: 10199-89-0 Molecular Formula: C6H2ClN3O3 Molecular Weight (g/mol): 199.55 MDL Number: MFCD00005808 InChI Key: IGHBXJSNZCFXNK-UHFFFAOYSA-N Synonym: 4-chloro-7-nitrobenzofurazan,nbd chloride,4-chloro-7-nitrobenzo-2-oxa-1,3-diazole,nbd-cl,7-chloro-4-nitrobenzofurazan,2,1,3-benzoxadiazole, 4-chloro-7-nitro,nbd-chloride,nbd-c 1,1-chloro-4-nitrobenzoxadiazole,4-nitro-7-chlorobenzofurazan PubChem CID: 25043 ChEBI: CHEBI:78878 IUPAC Name: 4-chloro-7-nitro-2,1,3-benzoxadiazole SMILES: C1=C(C2=NON=C2C(=C1)Cl)[N+](=O)[O-]

PubChem CID 25043
CAS 10199-89-0
Molecular Weight (g/mol) 199.55
ChEBI CHEBI:78878
MDL Number MFCD00005808
SMILES C1=C(C2=NON=C2C(=C1)Cl)[N+](=O)[O-]
Synonym 4-chloro-7-nitrobenzofurazan,nbd chloride,4-chloro-7-nitrobenzo-2-oxa-1,3-diazole,nbd-cl,7-chloro-4-nitrobenzofurazan,2,1,3-benzoxadiazole, 4-chloro-7-nitro,nbd-chloride,nbd-c 1,1-chloro-4-nitrobenzoxadiazole,4-nitro-7-chlorobenzofurazan
IUPAC Name 4-chloro-7-nitro-2,1,3-benzoxadiazole
InChI Key IGHBXJSNZCFXNK-UHFFFAOYSA-N
Molecular Formula C6H2ClN3O3
5

7-Fluorobenzofurazan-4-sulfonamide, 98%, Thermo Scientific Chemicals

CAS: 91366-65-3 Molecular Formula: C6H4FN3O3S Molecular Weight (g/mol): 217.17 MDL Number: MFCD00036687 InChI Key: XROXHZMRDABMHS-UHFFFAOYSA-N Synonym: abd-f,4-aminosulfonyl-7-fluoro-2,1,3-benzoxadiazole,7-fluorobenzofurazan-4-sulfonamide,4-fluoro-7-sulfamoylbenzofurazan,7-fluorobenzo c 1,2,5 oxadiazole-4-sulfonamide,4-aminosulphonyl-7-fluoro-2,1,3-benzoxadiazole,7-fluorobenzo c 1,2,5-oxadiazole-4-sulfonamide,pubchem23230,4-fluoro-7-sulfamoylbenzofurazane,4-fluoro-7-sulfoamoylbenzofurazan PubChem CID: 122067 IUPAC Name: 7-fluoro-2,1,3-benzoxadiazole-4-sulfonamide SMILES: NS(=O)(=O)C1=CC=C(F)C2=NON=C12

PubChem CID 122067
CAS 91366-65-3
Molecular Weight (g/mol) 217.17
MDL Number MFCD00036687
SMILES NS(=O)(=O)C1=CC=C(F)C2=NON=C12
Synonym abd-f,4-aminosulfonyl-7-fluoro-2,1,3-benzoxadiazole,7-fluorobenzofurazan-4-sulfonamide,4-fluoro-7-sulfamoylbenzofurazan,7-fluorobenzo c 1,2,5 oxadiazole-4-sulfonamide,4-aminosulphonyl-7-fluoro-2,1,3-benzoxadiazole,7-fluorobenzo c 1,2,5-oxadiazole-4-sulfonamide,pubchem23230,4-fluoro-7-sulfamoylbenzofurazane,4-fluoro-7-sulfoamoylbenzofurazan
IUPAC Name 7-fluoro-2,1,3-benzoxadiazole-4-sulfonamide
InChI Key XROXHZMRDABMHS-UHFFFAOYSA-N
Molecular Formula C6H4FN3O3S
6

Isradipine, 98+%, Thermo Scientific Chemicals

CAS: 75695-93-1 Molecular Formula: C19H21N3O5 Molecular Weight (g/mol): 371.39 MDL Number: MFCD00153820 InChI Key: HMJIYCCIJYRONP-UHFFFAOYNA-N Synonym: isradipine,dynacirc,isradipin,lomir,isrodipine,prescal,dynacirc cr,esradin,clivoten,dynacrine PubChem CID: 3784 IUPAC Name: 3-methyl 5-propan-2-yl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate SMILES: COC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC2=NON=C12)C(=O)OC(C)C

PubChem CID 3784
CAS 75695-93-1
Molecular Weight (g/mol) 371.39
MDL Number MFCD00153820
SMILES COC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC2=NON=C12)C(=O)OC(C)C
Synonym isradipine,dynacirc,isradipin,lomir,isrodipine,prescal,dynacirc cr,esradin,clivoten,dynacrine
IUPAC Name 3-methyl 5-propan-2-yl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
InChI Key HMJIYCCIJYRONP-UHFFFAOYNA-N
Molecular Formula C19H21N3O5
7

Benzofurazan-5-boronic acid pinacol ester, 97%, Thermo Scientific Chemicals

CAS: 1073355-14-2 Molecular Formula: C12H15BN2O3 Molecular Weight (g/mol): 246.07 MDL Number: MFCD09842717 InChI Key: MQXANAGMQAYTMV-UHFFFAOYSA-N Synonym: 5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzo c 1,2,5 oxadiazole,benzofurazan-5-boronic acid pinacol ester,5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2,1,3-benzoxadiazole,benzofurazan-5-boronic acid, pinacol ester,benzo c 1,2,5 oxadiazole-5-boronic acid, pinacol ester,5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzofurazan,benzo c 1,2,5 oxadiazole-5-boronic acid pinacol ester,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2,1,3-benzoxadiazole,benzo c 1,2,5 oxadiazol-5-ylboronic acid pinacol ester,amtb001 PubChem CID: 46738004 IUPAC Name: 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,1,3-benzoxadiazole SMILES: CC1(C)OB(OC1(C)C)C1=CC2=NON=C2C=C1

PubChem CID 46738004
CAS 1073355-14-2
Molecular Weight (g/mol) 246.07
MDL Number MFCD09842717
SMILES CC1(C)OB(OC1(C)C)C1=CC2=NON=C2C=C1
Synonym 5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzo c 1,2,5 oxadiazole,benzofurazan-5-boronic acid pinacol ester,5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2,1,3-benzoxadiazole,benzofurazan-5-boronic acid, pinacol ester,benzo c 1,2,5 oxadiazole-5-boronic acid, pinacol ester,5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzofurazan,benzo c 1,2,5 oxadiazole-5-boronic acid pinacol ester,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2,1,3-benzoxadiazole,benzo c 1,2,5 oxadiazol-5-ylboronic acid pinacol ester,amtb001
IUPAC Name 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,1,3-benzoxadiazole
InChI Key MQXANAGMQAYTMV-UHFFFAOYSA-N
Molecular Formula C12H15BN2O3
8

2,1,3-Benzoxadiazol-4-amine, 97%, Thermo Scientific™

CAS: 767-63-5 Molecular Formula: C6H5N3O Molecular Weight (g/mol): 135.126 MDL Number: MFCD00168448 InChI Key: IPCMVRZVNJHUHR-UHFFFAOYSA-N Synonym: 4-aminobenzofurazan,benzo 1,2,5 oxadiazol-4-ylamine,2,1,3-benzooxadiazol-4-ylamine,benzo c 1,2,5-oxadiazole-4-ylamine,benzofurazan-4-amine,benzofurazane-4-amine,acmc-209p5u,2,1,3-benzoxadiazol-7-amine,2,1,3-benzoxadiazol-4-ylamine,benzo c 1,2,5 oxadiazol-4-amine PubChem CID: 584570 IUPAC Name: 2,1,3-benzoxadiazol-4-amine SMILES: C1=CC2=NON=C2C(=C1)N

PubChem CID 584570
CAS 767-63-5
Molecular Weight (g/mol) 135.126
MDL Number MFCD00168448
SMILES C1=CC2=NON=C2C(=C1)N
Synonym 4-aminobenzofurazan,benzo 1,2,5 oxadiazol-4-ylamine,2,1,3-benzooxadiazol-4-ylamine,benzo c 1,2,5-oxadiazole-4-ylamine,benzofurazan-4-amine,benzofurazane-4-amine,acmc-209p5u,2,1,3-benzoxadiazol-7-amine,2,1,3-benzoxadiazol-4-ylamine,benzo c 1,2,5 oxadiazol-4-amine
IUPAC Name 2,1,3-benzoxadiazol-4-amine
InChI Key IPCMVRZVNJHUHR-UHFFFAOYSA-N
Molecular Formula C6H5N3O
9

2,1,3-Benzoxadiazol-4-ylmethanol, Thermo Scientific™

CAS: 175609-19-5 Molecular Formula: C7H6N2O2 Molecular Weight (g/mol): 150.14 MDL Number: MFCD04115376 InChI Key: OKDMFOBEJCALFD-UHFFFAOYSA-N Synonym: 4-hydroxymethylbenzofurazan,benzo c 1,2,5 oxadiazol-4-ylmethanol,4-hydroxymethyl-benzo c 1,2,5 oxadiazole,2,1,3-benzoxadiazole-4-methanol,1,2,3-benzoxadiazol-4-ylmethanol,benzo c 1,2,5-oxadiazol-4-ylmethan-1-ol PubChem CID: 2795215 IUPAC Name: 2,1,3-benzoxadiazol-4-ylmethanol SMILES: OCC1=CC=CC2=NON=C12

PubChem CID 2795215
CAS 175609-19-5
Molecular Weight (g/mol) 150.14
MDL Number MFCD04115376
SMILES OCC1=CC=CC2=NON=C12
Synonym 4-hydroxymethylbenzofurazan,benzo c 1,2,5 oxadiazol-4-ylmethanol,4-hydroxymethyl-benzo c 1,2,5 oxadiazole,2,1,3-benzoxadiazole-4-methanol,1,2,3-benzoxadiazol-4-ylmethanol,benzo c 1,2,5-oxadiazol-4-ylmethan-1-ol
IUPAC Name 2,1,3-benzoxadiazol-4-ylmethanol
InChI Key OKDMFOBEJCALFD-UHFFFAOYSA-N
Molecular Formula C7H6N2O2
10

Isradipine, Tocris Bioscience™
GREENER_CHOICE

CAS: 75695-93-1 Molecular Formula: C19H21N3O5 Molecular Weight (g/mol): 371.39 MDL Number: MFCD00153820 InChI Key: HMJIYCCIJYRONP-UHFFFAOYNA-N Synonym: isradipine,dynacirc,isradipin,lomir,isrodipine,prescal,dynacirc cr,esradin,clivoten,dynacrine PubChem CID: 3784 IUPAC Name: 3-methyl 5-propan-2-yl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate SMILES: COC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC2=NON=C12)C(=O)OC(C)C

PubChem CID 3784
CAS 75695-93-1
Molecular Weight (g/mol) 371.39
MDL Number MFCD00153820
SMILES COC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC2=NON=C12)C(=O)OC(C)C
Synonym isradipine,dynacirc,isradipin,lomir,isrodipine,prescal,dynacirc cr,esradin,clivoten,dynacrine
IUPAC Name 3-methyl 5-propan-2-yl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
InChI Key HMJIYCCIJYRONP-UHFFFAOYNA-N
Molecular Formula C19H21N3O5
11

Benzofuroxan 98.0+%, TCI America™
SDP

CAS: 480-96-6 Molecular Formula: C6H4N2O2 Molecular Weight (g/mol): 136.11 MDL Number: MFCD00005807 InChI Key: OKEAMBAZBICIFP-UHFFFAOYSA-N Synonym: benzofuroxan,benzofuroxane,benzofurazan 1-oxide,benzofurazan oxide,2,1,3-benzoxadiazole 1-oxide,2,1,3-benzoxadiazole, 1-oxide,benzofurazan, 1-oxide,2,1,3-benzoxadiazol-1-ium-1-olate,benzo c 1,2,5-oxadiazol-1-ol,benzofurazan n-oxide PubChem CID: 68075 IUPAC Name: 3-oxido-2,1,3-benzoxadiazol-3-ium SMILES: C1=CC2=NO[N+](=C2C=C1)[O-]

PubChem CID 68075
CAS 480-96-6
Molecular Weight (g/mol) 136.11
MDL Number MFCD00005807
SMILES C1=CC2=NO[N+](=C2C=C1)[O-]
Synonym benzofuroxan,benzofuroxane,benzofurazan 1-oxide,benzofurazan oxide,2,1,3-benzoxadiazole 1-oxide,2,1,3-benzoxadiazole, 1-oxide,benzofurazan, 1-oxide,2,1,3-benzoxadiazol-1-ium-1-olate,benzo c 1,2,5-oxadiazol-1-ol,benzofurazan n-oxide
IUPAC Name 3-oxido-2,1,3-benzoxadiazol-3-ium
InChI Key OKEAMBAZBICIFP-UHFFFAOYSA-N
Molecular Formula C6H4N2O2
12

2,1,3-Benzoxadiazole 98.0+%, TCI America™
SDP

CAS: 273-09-6 Molecular Formula: C6H4N2O Molecular Weight (g/mol): 120.111 MDL Number: MFCD00068064 InChI Key: AWBOSXFRPFZLOP-UHFFFAOYSA-N Synonym: benzofurazan,benzo c 1,2,5 oxadiazole,benzofurazane,2,1,3-benzoxadiazol,benzo-2,1,3-oxadiazole,2-oxa-1,3-diaza-2h-isoindene,3,5-cyclohexadiene-1,2-dione, dioxime, furazan,pubchem22999,acmc-209gwb PubChem CID: 67501 IUPAC Name: 2,1,3-benzoxadiazole SMILES: C1=CC2=NON=C2C=C1

PubChem CID 67501
CAS 273-09-6
Molecular Weight (g/mol) 120.111
MDL Number MFCD00068064
SMILES C1=CC2=NON=C2C=C1
Synonym benzofurazan,benzo c 1,2,5 oxadiazole,benzofurazane,2,1,3-benzoxadiazol,benzo-2,1,3-oxadiazole,2-oxa-1,3-diaza-2h-isoindene,3,5-cyclohexadiene-1,2-dione, dioxime, furazan,pubchem22999,acmc-209gwb
IUPAC Name 2,1,3-benzoxadiazole
InChI Key AWBOSXFRPFZLOP-UHFFFAOYSA-N
Molecular Formula C6H4N2O
13

4-Chloro-2,1,3-benzoxadiazole 98.0+%, TCI America™
SDP

CAS: 7116-16-7 Molecular Formula: C6H3ClN2O Molecular Weight (g/mol): 154.553 MDL Number: MFCD00191329 InChI Key: YLEBWUGKYMZPQQ-UHFFFAOYSA-N Synonym: 4-Chlorobenzofurazan PubChem CID: 592984 IUPAC Name: 4-chloro-2,1,3-benzoxadiazole SMILES: C1=CC2=NON=C2C(=C1)Cl

PubChem CID 592984
CAS 7116-16-7
Molecular Weight (g/mol) 154.553
MDL Number MFCD00191329
SMILES C1=CC2=NON=C2C(=C1)Cl
Synonym 4-Chlorobenzofurazan
IUPAC Name 4-chloro-2,1,3-benzoxadiazole
InChI Key YLEBWUGKYMZPQQ-UHFFFAOYSA-N
Molecular Formula C6H3ClN2O
14

4-Chloro-7-chlorosulfonyl-2,1,3-benzoxadiazole 97.0+%, TCI America™
SDP

CAS: 142246-48-8 Molecular Formula: C6H2Cl2N2O3S Molecular Weight (g/mol): 253.053 MDL Number: MFCD00191405 InChI Key: BPPRLMZEVZSIIJ-UHFFFAOYSA-N Synonym: 4-Chloro-2,1,3-benzoxadiazole-7-sulfonyl Chloride, 4-Chloro-7-chlorosulfonylbenzofurazan PubChem CID: 612515 IUPAC Name: 4-chloro-2,1,3-benzoxadiazole-7-sulfonyl chloride SMILES: C1=C(C2=NON=C2C(=C1)Cl)S(=O)(=O)Cl

PubChem CID 612515
CAS 142246-48-8
Molecular Weight (g/mol) 253.053
MDL Number MFCD00191405
SMILES C1=C(C2=NON=C2C(=C1)Cl)S(=O)(=O)Cl
Synonym 4-Chloro-2,1,3-benzoxadiazole-7-sulfonyl Chloride, 4-Chloro-7-chlorosulfonylbenzofurazan
IUPAC Name 4-chloro-2,1,3-benzoxadiazole-7-sulfonyl chloride
InChI Key BPPRLMZEVZSIIJ-UHFFFAOYSA-N
Molecular Formula C6H2Cl2N2O3S
15

DBD-H 98.0+%, TCI America™
SDP

CAS: 131467-86-2 Molecular Formula: C8H11N5O3S Molecular Weight (g/mol): 257.268 MDL Number: MFCD00191376 InChI Key: VPDDJYGQJSTHTA-UHFFFAOYSA-N Synonym: 4-(N,N-Dimethylaminosulfonyl)-7-hydrazinobenzofurazan, 4-(N,N-Dimethylaminosulfonyl)-7-hydrazino-2,1,3-benzoxadiazole PubChem CID: 131382 IUPAC Name: 7-hydrazinyl-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide SMILES: CN(C)S(=O)(=O)C1=CC=C(C2=NON=C12)NN

PubChem CID 131382
CAS 131467-86-2
Molecular Weight (g/mol) 257.268
MDL Number MFCD00191376
SMILES CN(C)S(=O)(=O)C1=CC=C(C2=NON=C12)NN
Synonym 4-(N,N-Dimethylaminosulfonyl)-7-hydrazinobenzofurazan, 4-(N,N-Dimethylaminosulfonyl)-7-hydrazino-2,1,3-benzoxadiazole
IUPAC Name 7-hydrazinyl-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide
InChI Key VPDDJYGQJSTHTA-UHFFFAOYSA-N
Molecular Formula C8H11N5O3S