2-[(4-acetamidophenyl)methylsulfanyl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[(4-acetamidophenyl)methylsulfanyl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[(4-acetamidophenyl)methylsulfanyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[(4-acetamidophenyl)methylthio]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[(4-acetamidophenyl)methylsulfanyl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[(4-acetamidobenzyl)thio]-1H-benzimidazole-4-carboxamide Formula: C17H16N4O2S MolecularWeight: 340.39954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CSC2=NC3=C(C=CC=C3N2)C(=O)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CSC2=NC3=C(C=CC=C3N2)C(=O)N

InChI

InChI=1S/C17H16N4O2S/c1-10(22)19-12-7-5-11(6-8-12)9-24-17-20-14-4-2-3-13(16(18)23)15(14)21-17/h2-8H,9H2,1H3,(H2,18,23)(H,19,22)(H,20,21)