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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCCCN4CCCCCC4

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCCCN4CCCCCC4

InChI

InChI=1S/C25H36N4O4S/c1-19-8-6-15-29(18-19)34(32,33)20-9-10-23-21(16-20)22(17-24(30)27-23)25(31)26-11-7-14-28-12-4-2-3-5-13-28/h9-10,16-17,19H,2-8,11-15,18H2,1H3,(H,26,31)(H,27,30)