N'-(2-methoxy-5-methyl-phenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide

Systemtic Name: N'-(2-methoxy-5-methyl-phenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide Openeye Name: N'-(2-methoxy-5-methyl-phenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]butanediamide CAS Name: N'-(2-methoxy-5-methylphenyl)-N-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]butanediamide IUPAC Name: N'-(2-methoxy-5-methylphenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide Traditional Name: N'-(2-methoxy-5-methyl-phenyl)-N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]succinamide Formula: C27H33N5O3 MolecularWeight: 475.58262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)CCC(=O)NC2=CC3=C(C=C2)N=C(C=C3C)N4CCN(CC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)CCC(=O)NC2=CC3=C(C=C2)N=C(C=C3C)N4CCN(CC4)C

InChI

InChI=1S/C27H33N5O3/c1-18-5-8-24(35-4)23(15-18)30-27(34)10-9-26(33)28-20-6-7-22-21(17-20)19(2)16-25(29-22)32-13-11-31(3)12-14-32/h5-8,15-17H,9-14H2,1-4H3,(H,28,33)(H,30,34)