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

Systemtic Name: N-(3-chlorophenyl)-3-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]benzenesulfonamide Openeye Name: N-(3-chlorophenyl)-3-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)benzenesulfonamide CAS Name: N-(3-chlorophenyl)-3-[(4-methylsulfonyl-1,4-diazepan-1-yl)-oxomethyl]benzenesulfonamide IUPAC Name: N-(3-chlorophenyl)-3-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)benzenesulfonamide Traditional Name: N-(3-chlorophenyl)-3-(4-mesyl-1,4-diazepane-1-carbonyl)benzenesulfonamide Formula: C19H22ClN3O5S2 MolecularWeight: 471.97808

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H22ClN3O5S2/c1-29(25,26)23-10-4-9-22(11-12-23)19(24)15-5-2-8-18(13-15)30(27,28)21-17-7-3-6-16(20)14-17/h2-3,5-8,13-14,21H,4,9-12H2,1H3