4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N-(3,4-dimethylphenyl)benzenesulfonamide

Systemtic Name: 4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N-(3,4-dimethylphenyl)benzenesulfonamide Openeye Name: 4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(3,4-dimethylphenyl)benzenesulfonamide CAS Name: 4-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-N-(3,4-dimethylphenyl)benzenesulfonamide IUPAC Name: 4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(3,4-dimethylphenyl)benzenesulfonamide Traditional Name: 4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(3,4-dimethylphenyl)benzenesulfonamide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4)C

InChI

InChI=1S/C27H35N3O4S/c1-20-7-10-24(19-21(20)2)28-35(33,34)25-11-8-22(9-12-25)26(31)30-17-13-23(14-18-30)27(32)29-15-5-3-4-6-16-29/h7-12,19,23,28H,3-6,13-18H2,1-2H3