2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-(1-benzylbenzimidazol-2-yl)sulfanylacetic acid CAS Name: 2-[[1-(phenylmethyl)-2-benzimidazolyl]thio]acetic acid IUPAC Name: 2-(1-benzylbenzimidazol-2-yl)sulfanylacetic acid Traditional Name: 2-[(1-benzylbenzimidazol-2-yl)thio]acetic acid Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SCC(=O)O

InChI

InChI=1S/C16H14N2O2S/c19-15(20)11-21-16-17-13-8-4-5-9-14(13)18(16)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,19,20)