N-(2-bromanyl-5-methoxy-phenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine

Systemtic Name: N-(2-bromanyl-5-methoxy-phenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: N-(2-bromo-5-methoxy-phenyl)-2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: N-(2-bromo-5-methoxyphenyl)-2-(3-pyridinyl)-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: N-(2-bromo-5-methoxyphenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: (2-bromo-5-methoxy-phenyl)-[2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]amine Formula: C17H12BrF3N4O MolecularWeight: 425.20259

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)NC2=NC(=NC(=C2)C(F)(F)F)C3=CN=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)Br)NC2=NC(=NC(=C2)C(F)(F)F)C3=CN=CC=C3

InChI

InChI=1S/C17H12BrF3N4O/c1-26-11-4-5-12(18)13(7-11)23-15-8-14(17(19,20)21)24-16(25-15)10-3-2-6-22-9-10/h2-9H,1H3,(H,23,24,25)