6-[2-fluoranyl-4-(trifluoromethyl)phenyl]-N4-(4-methoxypyridin-3-yl)pyrimidine-4,5-diamine

Systemtic Name: 6-[2-fluoranyl-4-(trifluoromethyl)phenyl]-N4-(4-methoxypyridin-3-yl)pyrimidine-4,5-diamine Openeye Name: 6-[2-fluoro-4-(trifluoromethyl)phenyl]-N4-(4-methoxy-3-pyridyl)pyrimidine-4,5-diamine CAS Name: 6-[2-fluoro-4-(trifluoromethyl)phenyl]-N4-(4-methoxy-3-pyridinyl)pyrimidine-4,5-diamine IUPAC Name: 6-[2-fluoro-4-(trifluoromethyl)phenyl]-4-N-(4-methoxypyridin-3-yl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-[2-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-(4-methoxy-3-pyridyl)amine Formula: C17H13F4N5O MolecularWeight: 379.311633

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=NC=C1)NC2=NC=NC(=C2N)C3=C(C=C(C=C3)C(F)(F)F)F

Isomeric SMILES

COC1=C(C=NC=C1)NC2=NC=NC(=C2N)C3=C(C=C(C=C3)C(F)(F)F)F

InChI

InChI=1S/C17H13F4N5O/c1-27-13-4-5-23-7-12(13)26-16-14(22)15(24-8-25-16)10-3-2-9(6-11(10)18)17(19,20)21/h2-8H,22H2,1H3,(H,24,25,26)