Benzenoids
Benzenoids
Fenoprefen calcium salt, Hydrate, MP Biomedicals™
CAS: 53746-45-5 Molecular Formula: C30H30CaO8 Molecular Weight (g/mol): 558.64 MDL Number: MFCD00242722 InChI Key: LZPBLUATTGKZBH-UHFFFAOYSA-L Synonym: fenopron,nalgesic,calcium-2-m-phenoxyphenyl propionate, hydrate,fenoprofen calcium salt,dl-2-3-phenoxyphenyl-propionic acid calcium salt, hydrate.,fenoprofen calcium;phenyloxy brufen,calcium salt,2-3-phenoxyphenyl propanoyl oxy calcio 2-3-phenoxyphenyl propanoate dihydrate,dihydrate 2-3-phenoxyphenyl propanoyl oxy calcio 2-3-phenoxyphenyl propanoate PubChem CID: 44119558 ChEBI: CHEBI:5005 IUPAC Name: calcium;2-(3-phenoxyphenyl)propanoate;dihydrate SMILES: CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-].CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-].O.O.[Ca+2]
Leucovorin Calcium, USP, 95-105%, Spectrum™ Chemical
CAS: 1492-18-8 Molecular Formula: C20H21CaN7O7 Molecular Weight (g/mol): 511.51 MDL Number: MFCD00006704 InChI Key: KVUAALJSMIVURS-AEQORCIRNA-L IUPAC Name: calcium (2S)-2-[(4-{[(2-amino-5-formyl-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioate SMILES: [Ca++].NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N1
Folinic acid, calcium salt, 99.4%, MP Biomedicals™
CAS: 1492-18-8 Molecular Formula: C20H21CaN7O7 Molecular Weight (g/mol): 511.51 MDL Number: MFCD00006704 InChI Key: KVUAALJSMIVURS-AEQORCIRNA-L Synonym: calcium folinate PubChem CID: 131675590 SMILES: [Ca++].NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N1
Folinic acid, calcium salt pentahydrate, 95.0-105.0%, Thermo Scientific Chemicals
CAS: 6035-45-6 Molecular Formula: C20H21CaN7O7·5H2O Molecular Weight (g/mol): 601.58 MDL Number: MFCD00149465 InChI Key: NPPBLUASYYNAIG-UHFFFAOYSA-L Synonym: folinic acid calcium pentahydrate PubChem CID: 131674093 IUPAC Name: calcium;4-[[4-[(2-amino-5-formyl-4-oxido-7,8-dihydro-6H-pteridin-6-yl)methylamino]benzoyl]amino]-5-hydroxy-5-oxopentanoate;pentahydrate SMILES: C1C(N(C2=C(N1)N=C(N=C2[O-])N)C=O)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)[O-])C(=O)O.O.O.O.O.O.[Ca+2]
Calcium Folinate Hydrate 98.0+%, TCI America™
CAS: 1492-18-8 Molecular Formula: C20H21CaN7O7 Molecular Weight (g/mol): 511.51 MDL Number: MFCD00006704 InChI Key: KVUAALJSMIVURS-AEQORCIRNA-L Synonym: calcium folinate PubChem CID: 131675590 IUPAC Name: calcium (2S)-2-[(4-{[(2-amino-5-formyl-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioate SMILES: [Ca++].NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N1
Calcium Dobesilate Hydrate 98.0+%, TCI America™
CAS: 117552-78-0 Molecular Formula: C12H12CaO11S2 Molecular Weight (g/mol): 436.415 MDL Number: MFCD00867249 InChI Key: JMTQBGBMQZPWCS-UHFFFAOYSA-L Synonym: Calcium 2,5-Dihydroxybenzenesulfonate, 2,5-Dihydroxybenzenesulfonic Acid Calcium Salt PubChem CID: 45358052 IUPAC Name: calcium;2,5-dihydroxybenzenesulfonate;hydrate SMILES: C1=CC(=C(C=C1O)S(=O)(=O)[O-])O.C1=CC(=C(C=C1O)S(=O)(=O)[O-])O.O.[Ca+2]
Fendiline hydrochloride
CAS: 13636-18-5 Molecular Formula: C23H26ClN Molecular Weight (g/mol): 351.918 MDL Number: MFCD00079301 InChI Key: NJXWZWXCHBNOOG-UHFFFAOYSA-N Synonym: fendiline hydrochloride,fendiline hcl,dsstox_cid_25860,dsstox_rid_81180,dsstox_gsid_45860,3,3-diphenyl-n-1-phenylethyl propan-1-amine hydrochloride,prestwick_568,sensit tn PubChem CID: 5702162 IUPAC Name: 3,3-diphenyl-N-(1-phenylethyl)propan-1-amine;hydrochloride SMILES: CC(C1=CC=CC=C1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3.Cl
Flunarizine dihydrochloride, 99%
CAS: 30484-77-6 Molecular Formula: C26H28Cl2F2N2 Molecular Weight (g/mol): 477.42 MDL Number: MFCD00058198 InChI Key: RXKMOPXNWTYEHI-RDRKJGRWSA-N Synonym: flunarizine dihydrochloride,flunarizine hydrochloride,flunarizine 2hcl,flunarizine hcl,flunarizine hydrochloride usan:jan,1-bis 4-fluorophenyl methyl-4-cinnamylpiperazine dihydrochloride,e-1-bis-p-fluorophenyl methyl-4-cinnamylpiperazine dihydrochloride,e-1-bis 4-fluorophenyl methyl-4-3-phenyl-2-propenyl piperazine dihydrochloride,e-1-bis 4-fluorophenyl methyl-4-cinnamylpiperazine dihydrochloride PubChem CID: 5282407 IUPAC Name: dihydrogen 1-[bis(4-fluorophenyl)methyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine dichloride SMILES: [H+].[H+].[Cl-].[Cl-].FC1=CC=C(C=C1)C(N1CCN(C\C=C\C2=CC=CC=C2)CC1)C1=CC=C(F)C=C1
Tolfenamic acid, 99+%, Thermo Scientific Chemicals
CAS: 13710-19-5 Molecular Formula: C14H12ClNO2 Molecular Weight (g/mol): 261.705 MDL Number: MFCD00133865 InChI Key: YEZNLOUZAIOMLT-UHFFFAOYSA-N Synonym: tolfenamic acid,clotam,n-3-chloro-2-methylphenyl anthranilic acid,2-3-chloro-2-methylphenyl amino benzoic acid,tolfedine,acido tolfenamico,acide tolfenamique,acidum tolfenamicum,tolfine,n-2-methyl-3-chlorophenyl anthranilic acid PubChem CID: 610479 ChEBI: CHEBI:32243 IUPAC Name: 2-(3-chloro-2-methylanilino)benzoic acid SMILES: CC1=C(C=CC=C1Cl)NC2=CC=CC=C2C(=O)O
R 568 hydrochloride, Tocris Bioscience™
CAS: 177172-49-5 Molecular Formula: C18H23Cl2NO Molecular Weight (g/mol): 340.288 InChI Key: YJXUXANREVNZLH-PFEQFJNWSA-N Synonym: r 568 hydrochloride,tecalcet hydrochloride,tecalcet hcl,norcalcin,unii-3hp28r98lc,tecalcet hydrochloride usan,r-3-2-chlorophenyl-n-1-3-methoxyphenyl ethyl propan-1-amine hydrochloride,3-2-chlorophenyl propyl 1r-1-3-methoxyphenyl ethyl amine hydrochloride PubChem CID: 158796 IUPAC Name: 3-(2-chlorophenyl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]propan-1-amine;hydrochloride SMILES: CC(C1=CC(=CC=C1)OC)NCCCC2=CC=CC=C2Cl.Cl
L-651,582, Tocris Bioscience™
CAS: 99519-84-3 Molecular Formula: C17H12Cl3N5O2 Molecular Weight (g/mol): 424.67 MDL Number: MFCD00866325 InChI Key: WNRZHQBJSXRYJK-UHFFFAOYSA-N Synonym: carboxyamidotriazole,carboxyamido-triazole,5-amino-1-3,5-dichloro-4-4-chlorobenzoyl benzyl-1h-1,2,3-triazole-4-carboxamide,cai,4-cai,unii-6st3zf52wb,6st3zf52wb,5-amino-1-3,5-dichloro-4-4-chlorobenzoyl phenyl methyl triazole-4-carboxamide,1h-1,2,3-triazole-4-carboxamide, 5-amino-1-3,5-dichloro-4-4-chlorobenzoyl phenyl methyl,5-amino-1-3,5-dichloro-4-4-chlorobenzoyl phenyl methyl-1h-1,2,3-triazole-4-carboxamide PubChem CID: 108144 IUPAC Name: 5-amino-1-{[3,5-dichloro-4-(4-chlorobenzoyl)phenyl]methyl}-1H-1,2,3-triazole-4-carboxamide SMILES: NC(=O)C1=C(N)N(CC2=CC(Cl)=C(C(=O)C3=CC=C(Cl)C=C3)C(Cl)=C2)N=N1
Calmidazolium chloride, Tocris Bioscience™
CAS: 57265-65-3 Molecular Formula: C31H23Cl7N2O Molecular Weight (g/mol): 687.688 InChI Key: YGEIMSMISRCBFF-UHFFFAOYSA-M Synonym: calmidazolium chloride,1-bis 4-chlorophenyl methyl-3-2-2,4-dichlorophenyl-2-2,4-dichlorophenyl methoxy ethyl imidazol-1-ium chloride,3-bis 4-chlorophenyl methyl-1-2-2,4-dichlorophenyl-2-2,4-dichlorophenyl methoxy ethyl imidazol-1-ium chloride,r 24571 chloride,methoxy ethyl-, chloride,methoxy ethyl-, chloride,calmidazolium chloride, solid,1-bis 4-chlorophenyl methyl-3-2,4-dichloro-,a-2,4-dichlorobenzyloxy phenethyl imidazolium chloride,1-bis 4-chlorophenyl methyl-3-2,4-dichloro-beta-2,4-dichlorobenzyloxy phenethyl imidazolium chloride,1-bis 4-chlorophenyl methyl-3-2,4-dichloro-beta-2,4-dichlorobenzyloxy phenethyl imidazolium chloride PubChem CID: 644274 IUPAC Name: 1-[bis(4-chlorophenyl)methyl]-3-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]imidazol-3-ium;chloride SMILES: C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)N3C=C[N+](=C3)CC(C4=C(C=C(C=C4)Cl)Cl)OCC5=C(C=C(C=C5)Cl)Cl)Cl.[Cl-]
(S)-(-)-Bay K 8644, Tocris Bioscience™
CAS: 98625-26-4 Molecular Formula: C16H15F3N2O4 Molecular Weight (g/mol): 356.301 InChI Key: ZFLWDHHVRRZMEI-ZDUSSCGKSA-N PubChem CID: 6603728 IUPAC Name: methyl (4S)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate SMILES: CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC
Arsenazo III, Thermo Scientific Chemicals
CAS: 1668-00-4 Molecular Formula: C22H18As2N4O14S2 Molecular Weight (g/mol): 776.363 MDL Number: MFCD00036695 InChI Key: TVMZRHVOFZTNET-RIRMOVKSSA-N Synonym: arsenazo iii,arsenazo iii sodium salt,2,2'-1, 8-dihydroxy-3,6-disulfo-2, 7-naphthalene-bis azo dibenzenearsonic acid,2,7-bis 2-arsonophenylazo-1, 8-dihydroxy-3, 6-naphthalene disulfonic acid,2,7-bis 2-arsonophenylazo-1,8-dihydroxynaphthalene-3,6-disulfonic acid,2,7-bis 2-arsonophenylazo chromotropic acid,2,2'-1,8-dihydroxy-3,6-disulfonaphthylene-2,7-bisazo bisbenzenearsonic acid,3,6-bis 2-2-arsonophenyl diazen-1-yl-4,5-dihydroxynaphthalene-2,7-disulfonic acid,3,6-bis 2-2-arsonophenyl diazenyl-4,5-dihydroxy-2,7-naphthalenedisulfonic acid,3,6-bis 2-2-arsonophenyl hydrazin-1-ylidene-4,5-dioxonaphthalene-2,7-disulfonic acid PubChem CID: 9810878 IUPAC Name: (3Z,6E)-3,6-bis[(2-arsonophenyl)hydrazinylidene]-4,5-dioxonaphthalene-2,7-disulfonic acid SMILES: C1=CC=C(C(=C1)NN=C2C(=CC3=C(C2=O)C(=O)C(=NNC4=CC=CC=C4[As](=O)(O)O)C(=C3)S(=O)(=O)O)S(=O)(=O)O)[As](=O)(O)O