N-[4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonylphenyl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonylphenyl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]phenyl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[4-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]phenyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]phenyl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]phenyl]-2,5-dimethyl-benzenesulfonamide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C27H35N3O4S/c1-20-7-8-21(2)25(19-20)35(33,34)28-24-11-9-22(10-12-24)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