N6-(2-ethylphenyl)-5-nitro-N4-[2-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine

Systemtic Name: N6-(2-ethylphenyl)-5-nitro-N4-[2-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine Openeye Name: N6-(2-ethylphenyl)-5-nitro-N4-[2-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine CAS Name: N6-(2-ethylphenyl)-5-nitro-N4-[2-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine IUPAC Name: 6-N-(2-ethylphenyl)-5-nitro-4-N-[2-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine Traditional Name: [6-(2-ethylanilino)-5-nitro-pyrimidin-4-yl]-[2-(trifluoromethyl)phenyl]amine Formula: C19H16F3N5O2 MolecularWeight: 403.35785

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=CC=CC=C3C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=CC=CC=C3C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H16F3N5O2/c1-2-12-7-3-5-9-14(12)25-17-16(27(28)29)18(24-11-23-17)26-15-10-6-4-8-13(15)19(20,21)22/h3-11H,2H2,1H3,(H2,23,24,25,26)