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

Systemtic Name: N-[3-[ethyl-(3-methylphenyl)amino]propyl]-6-(3-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-6-[(3-methyl-1-piperidyl)sulfonyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[3-(N-ethyl-3-methylanilino)propyl]-6-[(3-methyl-1-piperidinyl)sulfonyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[3-(N-ethyl-3-methylanilino)propyl]-6-(3-methylpiperidin-1-yl)sulfonyl-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-2-keto-6-(3-methylpiperidino)sulfonyl-1H-quinoline-4-carboxamide Formula: C28H36N4O4S MolecularWeight: 524.67484

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCC(C3)C)C4=CC=CC(=C4)C

Isomeric SMILES

CCN(CCCNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCC(C3)C)C4=CC=CC(=C4)C

InChI

InChI=1S/C28H36N4O4S/c1-4-31(22-10-5-8-20(2)16-22)14-7-13-29-28(34)25-18-27(33)30-26-12-11-23(17-24(25)26)37(35,36)32-15-6-9-21(3)19-32/h5,8,10-12,16-18,21H,4,6-7,9,13-15,19H2,1-3H3,(H,29,34)(H,30,33)