6-(azepan-1-ylsulfonyl)-N-[3-(2-methylpiperidin-1-yl)propyl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-[3-(2-methylpiperidin-1-yl)propyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-[3-(2-methyl-1-piperidyl)propyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-[3-(2-methyl-1-piperidinyl)propyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-[3-(2-methylpiperidin-1-yl)propyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-2-keto-N-[3-(2-methylpiperidino)propyl]-1H-quinoline-4-carboxamide Formula: C25H36N4O4S MolecularWeight: 488.64274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)C2=CC(=O)NC3=C2C=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1CCCCN1CCCNC(=O)C2=CC(=O)NC3=C2C=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H36N4O4S/c1-19-9-4-7-13-28(19)14-8-12-26-25(31)22-18-24(30)27-23-11-10-20(17-21(22)23)34(32,33)29-15-5-2-3-6-16-29/h10-11,17-19H,2-9,12-16H2,1H3,(H,26,31)(H,27,30)