6-(4-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-N-(4-phenylbutan-2-yl)-1H-quinoline-4-carboxamide

Systemtic Name: 6-(4-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-N-(4-phenylbutan-2-yl)-1H-quinoline-4-carboxamide Openeye Name: N-(1-methyl-3-phenyl-propyl)-6-[(4-methyl-1-piperidyl)sulfonyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: 6-[(4-methyl-1-piperidinyl)sulfonyl]-2-oxo-N-(4-phenylbutan-2-yl)-1H-quinoline-4-carboxamide IUPAC Name: 6-(4-methylpiperidin-1-yl)sulfonyl-2-oxo-N-(4-phenylbutan-2-yl)-1H-quinoline-4-carboxamide Traditional Name: 2-keto-N-(1-methyl-3-phenyl-propyl)-6-(4-methylpiperidino)sulfonyl-1H-quinoline-4-carboxamide Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NC(C)CCC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NC(C)CCC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O4S/c1-18-12-14-29(15-13-18)34(32,33)21-10-11-24-22(16-21)23(17-25(30)28-24)26(31)27-19(2)8-9-20-6-4-3-5-7-20/h3-7,10-11,16-19H,8-9,12-15H2,1-2H3,(H,27,31)(H,28,30)