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

Systemtic Name: 4-[[(3-chlorophenyl)sulfonyl-(2-oxidanylideneazepan-3-yl)amino]methyl]benzamide Openeye Name: 4-[[(3-chlorophenyl)sulfonyl-(2-oxoazepan-3-yl)amino]methyl]benzamide CAS Name: 4-[[(3-chlorophenyl)sulfonyl-(2-oxo-3-azepanyl)amino]methyl]benzamide IUPAC Name: 4-[[(3-chlorophenyl)sulfonyl-(2-oxoazepan-3-yl)amino]methyl]benzamide Traditional Name: 4-[[(3-chlorophenyl)sulfonyl-(2-ketoazepan-3-yl)amino]methyl]benzamide Formula: C20H22ClN3O4S MolecularWeight: 435.92438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O4S/c21-16-4-3-5-17(12-16)29(27,28)24(18-6-1-2-11-23-20(18)26)13-14-7-9-15(10-8-14)19(22)25/h3-5,7-10,12,18H,1-2,6,11,13H2,(H2,22,25)(H,23,26)