1-ethyl-4-oxidanylidene-6-piperidin-1-ylsulfonyl-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide

Systemtic Name: 1-ethyl-4-oxidanylidene-6-piperidin-1-ylsulfonyl-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide Openeye Name: 1-ethyl-4-oxo-6-(1-piperidylsulfonyl)-N-(2-pyridylmethyl)quinoline-3-carboxamide CAS Name: 1-ethyl-4-oxo-6-(1-piperidinylsulfonyl)-N-(2-pyridinylmethyl)-3-quinolinecarboxamide IUPAC Name: 1-ethyl-4-oxo-6-piperidin-1-ylsulfonyl-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide Traditional Name: 1-ethyl-4-keto-6-piperidinosulfonyl-N-(2-pyridylmethyl)quinoline-3-carboxamide Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCC3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCC3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C23H26N4O4S/c1-2-26-16-20(23(29)25-15-17-8-4-5-11-24-17)22(28)19-14-18(9-10-21(19)26)32(30,31)27-12-6-3-7-13-27/h4-5,8-11,14,16H,2-3,6-7,12-13,15H2,1H3,(H,25,29)