4-(azepan-1-ylsulfonyl)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(5-chloro-2-morpholino-phenyl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[5-chloro-2-(4-morpholinyl)phenyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(5-chloro-2-morpholin-4-ylphenyl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(5-chloro-2-morpholino-phenyl)benzamide Formula: C23H28ClN3O4S MolecularWeight: 478.00412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4

InChI

InChI=1S/C23H28ClN3O4S/c24-19-7-10-22(26-13-15-31-16-14-26)21(17-19)25-23(28)18-5-8-20(9-6-18)32(29,30)27-11-3-1-2-4-12-27/h5-10,17H,1-4,11-16H2,(H,25,28)