2-[2-(prop-2-enylsulfanylmethyl)benzimidazol-1-yl]carbonylbenzoic acid

Systemtic Name: 2-[2-(prop-2-enylsulfanylmethyl)benzimidazol-1-yl]carbonylbenzoic acid Openeye Name: 2-[2-(allylsulfanylmethyl)benzimidazole-1-carbonyl]benzoic acid CAS Name: 2-[oxo-[2-[(prop-2-enylthio)methyl]-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 2-[2-(prop-2-enylsulfanylmethyl)benzimidazole-1-carbonyl]benzoic acid Traditional Name: 2-[2-[(allylthio)methyl]benzimidazole-1-carbonyl]benzoic acid Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSCC1=NC2=CC=CC=C2N1C(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C=CCSCC1=NC2=CC=CC=C2N1C(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H16N2O3S/c1-2-11-25-12-17-20-15-9-5-6-10-16(15)21(17)18(22)13-7-3-4-8-14(13)19(23)24/h2-10H,1,11-12H2,(H,23,24)