N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-7-fluoranyl-2-oxidanylidene-3,4-dihydro-1H-quinoline-4-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-7-fluoranyl-2-oxidanylidene-3,4-dihydro-1H-quinoline-4-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-7-fluoro-2-keto-3,4-dihydro-1H-quinoline-4-carboxamide Formula: C23H26FN3O4S MolecularWeight: 459.533643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC(=O)NC3=C2C=CC(=C3)F)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC(=O)NC3=C2C=CC(=C3)F)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H26FN3O4S/c1-15-6-8-17(13-21(15)32(30,31)27-10-4-2-3-5-11-27)25-23(29)19-14-22(28)26-20-12-16(24)7-9-18(19)20/h6-9,12-13,19H,2-5,10-11,14H2,1H3,(H,25,29)(H,26,28)