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

Systemtic Name: N4-(2-ethoxyphenyl)-5-nitro-N6-[4-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine Openeye Name: N4-(2-ethoxyphenyl)-5-nitro-N6-[4-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine CAS Name: N4-(2-ethoxyphenyl)-5-nitro-N6-[4-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine IUPAC Name: 4-N-(2-ethoxyphenyl)-5-nitro-6-N-[4-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(o-phenetidino)pyrimidin-4-yl]-[4-(trifluoromethyl)phenyl]amine Formula: C19H16F3N5O3 MolecularWeight: 419.35725

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCOC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H16F3N5O3/c1-2-30-15-6-4-3-5-14(15)26-18-16(27(28)29)17(23-11-24-18)25-13-9-7-12(8-10-13)19(20,21)22/h3-11H,2H2,1H3,(H2,23,24,25,26)