2-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[(6-benzoyl-1H-benzimidazol-2-yl)sulfanyl]acetic acid CAS Name: 2-[(6-benzoyl-1H-benzimidazol-2-yl)thio]acetic acid IUPAC Name: 2-[(6-benzoyl-1H-benzimidazol-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(6-benzoyl-1H-benzimidazol-2-yl)thio]acetic acid Formula: C16H12N2O3S MolecularWeight: 312.34308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)N=C(N3)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)N=C(N3)SCC(=O)O

InChI

InChI=1S/C16H12N2O3S/c19-14(20)9-22-16-17-12-7-6-11(8-13(12)18-16)15(21)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,18)(H,19,20)