6-(4-fluoranyl-3-methyl-phenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinolin-4-amine

Systemtic Name: 6-(4-fluoranyl-3-methyl-phenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinolin-4-amine Openeye Name: 6-(4-fluoro-3-methyl-phenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinolin-4-amine CAS Name: 6-(4-fluoro-3-methylphenyl)-N-[4-(4-methyl-1-piperazinyl)phenyl]-4-quinolinamine IUPAC Name: 6-(4-fluoro-3-methylphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinolin-4-amine Traditional Name: [6-(4-fluoro-3-methyl-phenyl)-4-quinolyl]-[4-(4-methylpiperazino)phenyl]amine Formula: C27H27FN4 MolecularWeight: 426.528483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC3=C(C=CN=C3C=C2)NC4=CC=C(C=C4)N5CCN(CC5)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC3=C(C=CN=C3C=C2)NC4=CC=C(C=C4)N5CCN(CC5)C)F

InChI

InChI=1S/C27H27FN4/c1-19-17-20(3-9-25(19)28)21-4-10-26-24(18-21)27(11-12-29-26)30-22-5-7-23(8-6-22)32-15-13-31(2)14-16-32/h3-12,17-18H,13-16H2,1-2H3,(H,29,30)