3-(azepan-1-ylsulfonyl)-N-(2-quinolin-8-ylethyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(2-quinolin-8-ylethyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[2-(8-quinolyl)ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[2-(8-quinolinyl)ethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(2-quinolin-8-ylethyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[2-(8-quinolyl)ethyl]benzamide Formula: C24H27N3O3S MolecularWeight: 437.55448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C24H27N3O3S/c28-24(26-15-13-20-9-5-8-19-11-7-14-25-23(19)20)21-10-6-12-22(18-21)31(29,30)27-16-3-1-2-4-17-27/h5-12,14,18H,1-4,13,15-17H2,(H,26,28)