N-[6-(4-methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]pyridazin-3-yl]quinolin-7-amine

Systemtic Name: N-[6-(4-methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]pyridazin-3-yl]quinolin-7-amine Openeye Name: N-[6-(4-methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]pyridazin-3-yl]quinolin-7-amine CAS Name: N-[6-(4-methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]-3-pyridazinyl]-7-quinolinamine IUPAC Name: N-[6-(4-methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]pyridazin-3-yl]quinolin-7-amine Traditional Name: [6-(4-methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]pyridazin-3-yl]-(7-quinolyl)amine Formula: C27H19F3N4O MolecularWeight: 472.46117

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(C=C2C3=CC=C(C=C3)C(F)(F)F)NC4=CC5=C(C=CC=N5)C=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(C=C2C3=CC=C(C=C3)C(F)(F)F)NC4=CC5=C(C=CC=N5)C=C4

InChI

InChI=1S/C27H19F3N4O/c1-35-22-12-7-19(8-13-22)26-23(17-4-9-20(10-5-17)27(28,29)30)16-25(33-34-26)32-21-11-6-18-3-2-14-31-24(18)15-21/h2-16H,1H3,(H,32,33)