4-(azepan-1-yl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(azepan-1-yl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-4-oxidanylidene-butanamide Openeye Name: 4-(azepan-1-yl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]-4-oxo-butanamide CAS Name: 4-(1-azepanyl)-N-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]-4-oxobutanamide IUPAC Name: 4-(azepan-1-yl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-4-oxobutanamide Traditional Name: 4-(azepan-1-yl)-4-keto-N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]butyramide Formula: C25H35N5O2 MolecularWeight: 437.5777

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)N3CCCCCC3)N4CCN(CC4)C

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)N3CCCCCC3)N4CCN(CC4)C

InChI

InChI=1S/C25H35N5O2/c1-19-17-23(29-15-13-28(2)14-16-29)27-22-8-7-20(18-21(19)22)26-24(31)9-10-25(32)30-11-5-3-4-6-12-30/h7-8,17-18H,3-6,9-16H2,1-2H3,(H,26,31)