4-(azepan-1-ylsulfonyl)-N-(2-methyl-2-morpholin-4-yl-propyl)benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(2-methyl-2-morpholin-4-yl-propyl)benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(2-methyl-2-morpholino-propyl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[2-methyl-2-(4-morpholinyl)propyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(2-methyl-2-morpholino-propyl)benzamide Formula: C21H33N3O4S MolecularWeight: 423.56942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2)N3CCOCC3

Isomeric SMILES

CC(C)(CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2)N3CCOCC3

InChI

InChI=1S/C21H33N3O4S/c1-21(2,23-13-15-28-16-14-23)17-22-20(25)18-7-9-19(10-8-18)29(26,27)24-11-5-3-4-6-12-24/h7-10H,3-6,11-17H2,1-2H3,(H,22,25)