4-ethanoyl-N-[[4-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-ethanoyl-N-[[4-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]phenyl]methyl]benzenesulfonamide Openeye Name: 4-acetyl-N-[[4-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)phenyl]methyl]benzenesulfonamide CAS Name: 4-acetyl-N-[[4-[(4-methylsulfonyl-1,4-diazepan-1-yl)-oxomethyl]phenyl]methyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-[[4-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)phenyl]methyl]benzenesulfonamide Traditional Name: 4-acetyl-N-[4-(4-mesyl-1,4-diazepane-1-carbonyl)benzyl]benzenesulfonamide Formula: C22H27N3O6S2 MolecularWeight: 493.59628

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C22H27N3O6S2/c1-17(26)19-8-10-21(11-9-19)33(30,31)23-16-18-4-6-20(7-5-18)22(27)24-12-3-13-25(15-14-24)32(2,28)29/h4-11,23H,3,12-16H2,1-2H3