N-[4-(1,4-diazepan-1-yl)-2-[methyl(phenylsulfonyl)amino]phenyl]benzenesulfonamide

Systemtic Name: N-[4-(1,4-diazepan-1-yl)-2-[methyl(phenylsulfonyl)amino]phenyl]benzenesulfonamide Openeye Name: N-[2-[benzenesulfonyl(methyl)amino]-4-(1,4-diazepan-1-yl)phenyl]benzenesulfonamide CAS Name: N-[2-[benzenesulfonyl(methyl)amino]-4-(1,4-diazepan-1-yl)phenyl]benzenesulfonamide IUPAC Name: N-[2-[benzenesulfonyl(methyl)amino]-4-(1,4-diazepan-1-yl)phenyl]benzenesulfonamide Traditional Name: N-[2-[besyl(methyl)amino]-4-(1,4-diazepan-1-yl)phenyl]benzenesulfonamide Formula: C24H28N4O4S2 MolecularWeight: 500.63352

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C=CC(=C1)N2CCCNCC2)NS(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN(C1=C(C=CC(=C1)N2CCCNCC2)NS(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O4S2/c1-27(34(31,32)22-11-6-3-7-12-22)24-19-20(28-17-8-15-25-16-18-28)13-14-23(24)26-33(29,30)21-9-4-2-5-10-21/h2-7,9-14,19,25-26H,8,15-18H2,1H3