6-(3-methoxypyridin-2-yl)-N-[4-(trifluoromethyl)phenyl]phthalazin-1-amine

Systemtic Name: 6-(3-methoxypyridin-2-yl)-N-[4-(trifluoromethyl)phenyl]phthalazin-1-amine Openeye Name: 6-(3-methoxy-2-pyridyl)-N-[4-(trifluoromethyl)phenyl]phthalazin-1-amine CAS Name: 6-(3-methoxy-2-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1-phthalazinamine IUPAC Name: 6-(3-methoxypyridin-2-yl)-N-[4-(trifluoromethyl)phenyl]phthalazin-1-amine Traditional Name: [6-(3-methoxy-2-pyridyl)phthalazin-1-yl]-[4-(trifluoromethyl)phenyl]amine Formula: C21H15F3N4O MolecularWeight: 396.36521

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=CC=C1)C2=CC3=CN=NC(=C3C=C2)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

COC1=C(N=CC=C1)C2=CC3=CN=NC(=C3C=C2)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H15F3N4O/c1-29-18-3-2-10-25-19(18)13-4-9-17-14(11-13)12-26-28-20(17)27-16-7-5-15(6-8-16)21(22,23)24/h2-12H,1H3,(H,27,28)