N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(benzimidazol-1-yl)propanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(benzimidazol-1-yl)propanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(benzimidazol-1-yl)propanamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-3-(1-benzimidazolyl)propanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(benzimidazol-1-yl)propanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(benzimidazol-1-yl)propionamide Formula: C22H26N4O3S MolecularWeight: 426.53184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCN3C=NC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H26N4O3S/c27-22(12-15-25-17-23-20-10-3-4-11-21(20)25)24-18-8-7-9-19(16-18)30(28,29)26-13-5-1-2-6-14-26/h3-4,7-11,16-17H,1-2,5-6,12-15H2,(H,24,27)