N-(2-methoxy-5-nitro-phenyl)-2-pyrazin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-pyrazin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: N-(2-methoxy-5-nitro-phenyl)-2-pyrazin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: N-(2-methoxy-5-nitrophenyl)-2-(2-pyrazinyl)-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: N-(2-methoxy-5-nitrophenyl)-2-pyrazin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: (2-methoxy-5-nitro-phenyl)-[2-pyrazin-2-yl-6-(trifluoromethyl)pyrimidin-4-yl]amine Formula: C16H11F3N6O3 MolecularWeight: 392.29215

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2=NC(=NC(=C2)C(F)(F)F)C3=NC=CN=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2=NC(=NC(=C2)C(F)(F)F)C3=NC=CN=C3

InChI

InChI=1S/C16H11F3N6O3/c1-28-12-3-2-9(25(26)27)6-10(12)22-14-7-13(16(17,18)19)23-15(24-14)11-8-20-4-5-21-11/h2-8H,1H3,(H,22,23,24)