2-[2-[(3-ethanoylphenyl)methylsulfanyl]benzimidazol-1-yl]ethanoic acid

Systemtic Name: 2-[2-[(3-ethanoylphenyl)methylsulfanyl]benzimidazol-1-yl]ethanoic acid Openeye Name: 2-[2-[(3-acetylphenyl)methylsulfanyl]benzimidazol-1-yl]acetic acid CAS Name: 2-[2-[(3-acetylphenyl)methylthio]-1-benzimidazolyl]acetic acid IUPAC Name: 2-[2-[(3-acetylphenyl)methylsulfanyl]benzimidazol-1-yl]acetic acid Traditional Name: 2-[2-[(3-acetylbenzyl)thio]benzimidazol-1-yl]acetic acid Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)CSC2=NC3=CC=CC=C3N2CC(=O)O

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)CSC2=NC3=CC=CC=C3N2CC(=O)O

InChI

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