N'-(3-chloranyl-4-methoxy-phenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide

Systemtic Name: N'-(3-chloranyl-4-methoxy-phenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide Openeye Name: N'-(3-chloro-4-methoxy-phenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]butanediamide CAS Name: N'-(3-chloro-4-methoxyphenyl)-N-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]butanediamide IUPAC Name: N'-(3-chloro-4-methoxyphenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]butanediamide Traditional Name: N'-(3-chloro-4-methoxy-phenyl)-N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]succinamide Formula: C26H30ClN5O3 MolecularWeight: 496.0011

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)NC3=CC(=C(C=C3)OC)Cl)N4CCN(CC4)C

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)NC3=CC(=C(C=C3)OC)Cl)N4CCN(CC4)C

InChI

InChI=1S/C26H30ClN5O3/c1-17-14-24(32-12-10-31(2)11-13-32)30-22-6-4-18(15-20(17)22)28-25(33)8-9-26(34)29-19-5-7-23(35-3)21(27)16-19/h4-7,14-16H,8-13H2,1-3H3,(H,28,33)(H,29,34)