N-butyl-6-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-butyl-6-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-butyl-6-[(3,5-dimethyl-1-piperidyl)sulfonyl]-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-butyl-6-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-butyl-6-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-butyl-6-(3,5-dimethylpiperidino)sulfonyl-4-keto-1H-quinoline-3-carboxamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CNC2=C(C1=O)C=C(C=C2)S(=O)(=O)N3CC(CC(C3)C)C

Isomeric SMILES

CCCCNC(=O)C1=CNC2=C(C1=O)C=C(C=C2)S(=O)(=O)N3CC(CC(C3)C)C

InChI

InChI=1S/C21H29N3O4S/c1-4-5-8-22-21(26)18-11-23-19-7-6-16(10-17(19)20(18)25)29(27,28)24-12-14(2)9-15(3)13-24/h6-7,10-11,14-15H,4-5,8-9,12-13H2,1-3H3,(H,22,26)(H,23,25)