N-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-oxidanylidene-propyl]-3,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-oxidanylidene-propyl]-3,4-dimethyl-benzenesulfonamide Openeye Name: N-[3-[4-(azepane-1-carbonyl)-1-piperidyl]-3-oxo-propyl]-3,4-dimethyl-benzenesulfonamide CAS Name: N-[3-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-3-oxopropyl]-3,4-dimethylbenzenesulfonamide IUPAC Name: N-[3-[4-(azepane-1-carbonyl)piperidin-1-yl]-3-oxopropyl]-3,4-dimethylbenzenesulfonamide Traditional Name: N-[3-[4-(azepane-1-carbonyl)piperidino]-3-keto-propyl]-3,4-dimethyl-benzenesulfonamide Formula: C23H35N3O4S MolecularWeight: 449.6067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)N2CCC(CC2)C(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)N2CCC(CC2)C(=O)N3CCCCCC3)C

InChI

InChI=1S/C23H35N3O4S/c1-18-7-8-21(17-19(18)2)31(29,30)24-12-9-22(27)25-15-10-20(11-16-25)23(28)26-13-5-3-4-6-14-26/h7-8,17,20,24H,3-6,9-16H2,1-2H3