3-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methoxyphenyl)propanamide

Systemtic Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methoxyphenyl)propanamide Openeye Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methoxyphenyl)propanamide CAS Name: 3-(1H-benzimidazol-2-ylthio)-N-(4-methoxyphenyl)propanamide IUPAC Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methoxyphenyl)propanamide Traditional Name: 3-(1H-benzimidazol-2-ylthio)-N-(4-methoxyphenyl)propionamide Formula: C17H17N3O2S MolecularWeight: 327.40078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C17H17N3O2S/c1-22-13-8-6-12(7-9-13)18-16(21)10-11-23-17-19-14-4-2-3-5-15(14)20-17/h2-9H,10-11H2,1H3,(H,18,21)(H,19,20)