N-(3-chlorophenyl)-N-methyl-3-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]benzenesulfonamide

Systemtic Name: N-(3-chlorophenyl)-N-methyl-3-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]benzenesulfonamide Openeye Name: 3-(4-benzyl-1,4-diazepane-1-carbonyl)-N-(3-chlorophenyl)-N-methyl-benzenesulfonamide CAS Name: N-(3-chlorophenyl)-N-methyl-3-[oxo-[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]benzenesulfonamide IUPAC Name: 3-(4-benzyl-1,4-diazepane-1-carbonyl)-N-(3-chlorophenyl)-N-methylbenzenesulfonamide Traditional Name: 3-(4-benzyl-1,4-diazepane-1-carbonyl)-N-(3-chlorophenyl)-N-methyl-benzenesulfonamide Formula: C26H28ClN3O3S MolecularWeight: 498.03682

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN(C1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H28ClN3O3S/c1-28(24-12-6-11-23(27)19-24)34(32,33)25-13-5-10-22(18-25)26(31)30-15-7-14-29(16-17-30)20-21-8-3-2-4-9-21/h2-6,8-13,18-19H,7,14-17,20H2,1H3