6-(azepan-1-ylsulfonyl)-N-[2-[butyl(methyl)amino]ethyl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-[2-[butyl(methyl)amino]ethyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-[2-[butyl(methyl)amino]ethyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-[2-[butyl(methyl)amino]ethyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-[2-[butyl(methyl)amino]ethyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-N-[2-[butyl(methyl)amino]ethyl]-2-keto-1H-quinoline-4-carboxamide Formula: C23H34N4O4S MolecularWeight: 462.60546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)CCNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCCCN(C)CCNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H34N4O4S/c1-3-4-12-26(2)15-11-24-23(29)20-17-22(28)25-21-10-9-18(16-19(20)21)32(30,31)27-13-7-5-6-8-14-27/h9-10,16-17H,3-8,11-15H2,1-2H3,(H,24,29)(H,25,28)