6-(5-fluoranyl-2-methoxy-phenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinolin-4-amine

Systemtic Name: 6-(5-fluoranyl-2-methoxy-phenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinolin-4-amine Openeye Name: 6-(5-fluoro-2-methoxy-phenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinolin-4-amine CAS Name: 6-(5-fluoro-2-methoxyphenyl)-N-[4-(4-methyl-1-piperazinyl)phenyl]-4-quinolinamine IUPAC Name: 6-(5-fluoro-2-methoxyphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinolin-4-amine Traditional Name: [6-(5-fluoro-2-methoxy-phenyl)-4-quinolyl]-[4-(4-methylpiperazino)phenyl]amine Formula: C27H27FN4O MolecularWeight: 442.527883

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC3=C4C=C(C=CC4=NC=C3)C5=C(C=CC(=C5)F)OC

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC3=C4C=C(C=CC4=NC=C3)C5=C(C=CC(=C5)F)OC

InChI

InChI=1S/C27H27FN4O/c1-31-13-15-32(16-14-31)22-7-5-21(6-8-22)30-26-11-12-29-25-9-3-19(17-24(25)26)23-18-20(28)4-10-27(23)33-2/h3-12,17-18H,13-16H2,1-2H3,(H,29,30)