N-(1H-benzimidazol-2-ylmethyl)-2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanamide Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-N-(1H-benzimidazol-2-ylmethyl)acetamide CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-N-(1H-benzimidazol-2-ylmethyl)acetamide IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-N-(1H-benzimidazol-2-ylmethyl)acetamide Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-N-(1H-benzimidazol-2-ylmethyl)acetamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)NCC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)NCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C20H21N3O3S/c1-13(24)14-7-8-18(26-2)15(9-14)11-27-12-20(25)21-10-19-22-16-5-3-4-6-17(16)23-19/h3-9H,10-12H2,1-2H3,(H,21,25)(H,22,23)