4-[[(4-chlorophenyl)sulfonyl-(5,5-dimethyl-2-oxidanylidene-azepan-3-yl)amino]methyl]benzamide

Systemtic Name: 4-[[(4-chlorophenyl)sulfonyl-(5,5-dimethyl-2-oxidanylidene-azepan-3-yl)amino]methyl]benzamide Openeye Name: 4-[[(4-chlorophenyl)sulfonyl-(5,5-dimethyl-2-oxo-azepan-3-yl)amino]methyl]benzamide CAS Name: 4-[[(4-chlorophenyl)sulfonyl-(5,5-dimethyl-2-oxo-3-azepanyl)amino]methyl]benzamide IUPAC Name: 4-[[(4-chlorophenyl)sulfonyl-(5,5-dimethyl-2-oxoazepan-3-yl)amino]methyl]benzamide Traditional Name: 4-[[(4-chlorophenyl)sulfonyl-(2-keto-5,5-dimethyl-azepan-3-yl)amino]methyl]benzamide Formula: C22H26ClN3O4S MolecularWeight: 463.97754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCNC(=O)C(C1)N(CC2=CC=C(C=C2)C(=O)N)S(=O)(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1(CCNC(=O)C(C1)N(CC2=CC=C(C=C2)C(=O)N)S(=O)(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H26ClN3O4S/c1-22(2)11-12-25-21(28)19(13-22)26(14-15-3-5-16(6-4-15)20(24)27)31(29,30)18-9-7-17(23)8-10-18/h3-10,19H,11-14H2,1-2H3,(H2,24,27)(H,25,28)