3-(1H-benzimidazol-2-ylsulfanyl)-N-(2-nitrophenyl)propanamide

Systemtic Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(2-nitrophenyl)propanamide Openeye Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(2-nitrophenyl)propanamide CAS Name: 3-(1H-benzimidazol-2-ylthio)-N-(2-nitrophenyl)propanamide IUPAC Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(2-nitrophenyl)propanamide Traditional Name: 3-(1H-benzimidazol-2-ylthio)-N-(2-nitrophenyl)propionamide Formula: C16H14N4O3S MolecularWeight: 342.37236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O3S/c21-15(17-13-7-3-4-8-14(13)20(22)23)9-10-24-16-18-11-5-1-2-6-12(11)19-16/h1-8H,9-10H2,(H,17,21)(H,18,19)