2-[2-(1-oxidanylidene-1-phenyl-propan-2-yl)sulfanylbenzimidazol-1-yl]ethanoic acid

Systemtic Name: 2-[2-(1-oxidanylidene-1-phenyl-propan-2-yl)sulfanylbenzimidazol-1-yl]ethanoic acid Openeye Name: 2-[2-(1-methyl-2-oxo-2-phenyl-ethyl)sulfanylbenzimidazol-1-yl]acetic acid CAS Name: 2-[2-[(1-oxo-1-phenylpropan-2-yl)thio]-1-benzimidazolyl]acetic acid IUPAC Name: 2-[2-(1-oxo-1-phenylpropan-2-yl)sulfanylbenzimidazol-1-yl]acetic acid Traditional Name: 2-[2-[(2-keto-1-methyl-2-phenyl-ethyl)thio]benzimidazol-1-yl]acetic acid Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)SC2=NC3=CC=CC=C3N2CC(=O)O

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)SC2=NC3=CC=CC=C3N2CC(=O)O

InChI

InChI=1S/C18H16N2O3S/c1-12(17(23)13-7-3-2-4-8-13)24-18-19-14-9-5-6-10-15(14)20(18)11-16(21)22/h2-10,12H,11H2,1H3,(H,21,22)