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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)C(F)(F)F

InChI

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