N-[3-(benzimidazol-1-yl)propyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-2-(phenylthio)nicotinamide Formula: C22H20N4OS MolecularWeight: 388.4854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCCN3C=NC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H20N4OS/c27-21(18-10-6-13-24-22(18)28-17-8-2-1-3-9-17)23-14-7-15-26-16-25-19-11-4-5-12-20(19)26/h1-6,8-13,16H,7,14-15H2,(H,23,27)