(4-ethanoylphenyl) 2-(1H-benzimidazol-2-ylmethylsulfanyl)ethanoate

Systemtic Name: (4-ethanoylphenyl) 2-(1H-benzimidazol-2-ylmethylsulfanyl)ethanoate Openeye Name: (4-acetylphenyl) 2-(1H-benzimidazol-2-ylmethylsulfanyl)acetate CAS Name: 2-(1H-benzimidazol-2-ylmethylthio)acetic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 2-(1H-benzimidazol-2-ylmethylsulfanyl)acetate Traditional Name: 2-(1H-benzimidazol-2-ylmethylthio)acetic acid (4-acetylphenyl) ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)CSCC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)CSCC2=NC3=CC=CC=C3N2

InChI

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