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

Systemtic Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxidanylidene-5-phenyl-azepan-3-yl)amino]methyl]-N-cyclopropyl-benzamide Openeye Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxo-5-phenyl-azepan-3-yl)amino]methyl]-N-cyclopropyl-benzamide CAS Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxo-5-phenyl-3-azepanyl)amino]methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[[(4-chlorophenyl)sulfonyl-(2-oxo-5-phenylazepan-3-yl)amino]methyl]-N-cyclopropylbenzamide Traditional Name: 4-[[(4-chlorophenyl)sulfonyl-(2-keto-5-phenyl-azepan-3-yl)amino]methyl]-N-cyclopropyl-benzamide Formula: C29H30ClN3O4S MolecularWeight: 552.0842

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)CN(C3CC(CCNC3=O)C4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)CN(C3CC(CCNC3=O)C4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H30ClN3O4S/c30-24-10-14-26(15-11-24)38(36,37)33(19-20-6-8-22(9-7-20)28(34)32-25-12-13-25)27-18-23(16-17-31-29(27)35)21-4-2-1-3-5-21/h1-11,14-15,23,25,27H,12-13,16-19H2,(H,31,35)(H,32,34)