ethyl 4-[6-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-ethyl-4-oxidanylidene-quinolin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-ethyl-4-oxidanylidene-quinolin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[6-[(3,5-dimethyl-1-piperidyl)sulfonyl]-1-ethyl-4-oxo-quinoline-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[6-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-1-ethyl-4-oxo-3-quinolinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-ethyl-4-oxoquinoline-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[6-(3,5-dimethylpiperidino)sulfonyl-1-ethyl-4-keto-quinoline-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H36N4O6S MolecularWeight: 532.65224

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CC(CC(C3)C)C)C(=O)N4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CC(CC(C3)C)C)C(=O)N4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C26H36N4O6S/c1-5-27-17-22(25(32)28-9-11-29(12-10-28)26(33)36-6-2)24(31)21-14-20(7-8-23(21)27)37(34,35)30-15-18(3)13-19(4)16-30/h7-8,14,17-19H,5-6,9-13,15-16H2,1-4H3