2-(2-butylsulfanylbenzimidazol-1-yl)carbonylbenzoic acid

Systemtic Name: 2-(2-butylsulfanylbenzimidazol-1-yl)carbonylbenzoic acid Openeye Name: 2-(2-butylsulfanylbenzimidazole-1-carbonyl)benzoic acid CAS Name: 2-[[2-(butylthio)-1-benzimidazolyl]-oxomethyl]benzoic acid IUPAC Name: 2-(2-butylsulfanylbenzimidazole-1-carbonyl)benzoic acid Traditional Name: 2-[2-(butylthio)benzimidazole-1-carbonyl]benzoic acid Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=CC=CC=C2N1C(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CCCCSC1=NC2=CC=CC=C2N1C(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H18N2O3S/c1-2-3-12-25-19-20-15-10-6-7-11-16(15)21(19)17(22)13-8-4-5-9-14(13)18(23)24/h4-11H,2-3,12H2,1H3,(H,23,24)