4-[[(4-chlorophenyl)sulfonyl-(2-oxidanylideneazepan-3-yl)amino]methyl]-N-(1-phenylethyl)benzamide

Systemtic Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxidanylideneazepan-3-yl)amino]methyl]-N-(1-phenylethyl)benzamide Openeye Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxoazepan-3-yl)amino]methyl]-N-(1-phenylethyl)benzamide CAS Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxo-3-azepanyl)amino]methyl]-N-(1-phenylethyl)benzamide IUPAC Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxoazepan-3-yl)amino]methyl]-N-(1-phenylethyl)benzamide Traditional Name: 4-[[(4-chlorophenyl)sulfonyl-(2-ketoazepan-3-yl)amino]methyl]-N-(1-phenylethyl)benzamide Formula: C28H30ClN3O4S MolecularWeight: 540.0735

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)CN(C3CCCCNC3=O)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)CN(C3CCCCNC3=O)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H30ClN3O4S/c1-20(22-7-3-2-4-8-22)31-27(33)23-12-10-21(11-13-23)19-32(26-9-5-6-18-30-28(26)34)37(35,36)25-16-14-24(29)15-17-25/h2-4,7-8,10-17,20,26H,5-6,9,18-19H2,1H3,(H,30,34)(H,31,33)