3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N-(2,4-dimethylphenyl)benzenesulfonamide

Systemtic Name: 3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N-(2,4-dimethylphenyl)benzenesulfonamide Openeye Name: 3-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(2,4-dimethylphenyl)benzenesulfonamide CAS Name: 3-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-N-(2,4-dimethylphenyl)benzenesulfonamide IUPAC Name: 3-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(2,4-dimethylphenyl)benzenesulfonamide Traditional Name: 3-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(2,4-dimethylphenyl)benzenesulfonamide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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