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

Systemtic Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxidanylidene-5-propan-2-yl-azepan-3-yl)amino]methyl]benzamide Openeye Name: 4-[[(4-chlorophenyl)sulfonyl-(5-isopropyl-2-oxo-azepan-3-yl)amino]methyl]benzamide CAS Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxo-5-propan-2-yl-3-azepanyl)amino]methyl]benzamide IUPAC Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxo-5-propan-2-ylazepan-3-yl)amino]methyl]benzamide Traditional Name: 4-[[(4-chlorophenyl)sulfonyl-(5-isopropyl-2-keto-azepan-3-yl)amino]methyl]benzamide Formula: C23H28ClN3O4S MolecularWeight: 478.00412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCNC(=O)C(C1)N(CC2=CC=C(C=C2)C(=O)N)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C1CCNC(=O)C(C1)N(CC2=CC=C(C=C2)C(=O)N)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H28ClN3O4S/c1-15(2)18-11-12-26-23(29)21(13-18)27(14-16-3-5-17(6-4-16)22(25)28)32(30,31)20-9-7-19(24)8-10-20/h3-10,15,18,21H,11-14H2,1-2H3,(H2,25,28)(H,26,29)