6-(azepan-1-ylsulfonyl)-N-[3-[ethyl-(3-methylphenyl)amino]propyl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-[3-[ethyl-(3-methylphenyl)amino]propyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-[3-(N-ethyl-3-methyl-anilino)propyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-[3-(N-ethyl-3-methylanilino)propyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-[3-(N-ethyl-3-methylanilino)propyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-N-[3-(N-ethyl-3-methyl-anilino)propyl]-2-keto-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)N3CCCCCC3)C4=CC=CC(=C4)C

Isomeric SMILES

CCN(CCCNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C4=CC=CC(=C4)C

InChI

InChI=1S/C28H36N4O4S/c1-3-31(22-11-8-10-21(2)18-22)15-9-14-29-28(34)25-20-27(33)30-26-13-12-23(19-24(25)26)37(35,36)32-16-6-4-5-7-17-32/h8,10-13,18-20H,3-7,9,14-17H2,1-2H3,(H,29,34)(H,30,33)