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

Systemtic Name: N-(2-methoxy-5-methyl-4-nitro-phenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: N-(2-methoxy-5-methyl-4-nitro-phenyl)-2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: N-(2-methoxy-5-methyl-4-nitrophenyl)-2-(3-pyridinyl)-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: N-(2-methoxy-5-methyl-4-nitrophenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: (2-methoxy-5-methyl-4-nitro-phenyl)-[2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]amine Formula: C18H14F3N5O3 MolecularWeight: 405.33067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1[N+](=O)[O-])OC)NC2=NC(=NC(=C2)C(F)(F)F)C3=CN=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1[N+](=O)[O-])OC)NC2=NC(=NC(=C2)C(F)(F)F)C3=CN=CC=C3

InChI

InChI=1S/C18H14F3N5O3/c1-10-6-12(14(29-2)7-13(10)26(27)28)23-16-8-15(18(19,20)21)24-17(25-16)11-4-3-5-22-9-11/h3-9H,1-2H3,(H,23,24,25)