N-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonylphenyl]benzenesulfonamide

Systemtic Name: N-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonylphenyl]benzenesulfonamide Openeye Name: N-[3-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]phenyl]benzenesulfonamide CAS Name: N-[3-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: N-[3-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]phenyl]benzenesulfonamide Traditional Name: N-[3-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]phenyl]benzenesulfonamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O4S/c29-24(27-15-6-1-2-7-16-27)20-13-17-28(18-14-20)25(30)21-9-8-10-22(19-21)26-33(31,32)23-11-4-3-5-12-23/h3-5,8-12,19-20,26H,1-2,6-7,13-18H2