N2-(4-ethoxyphenyl)-N4-(3-fluorophenyl)-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N2-(4-ethoxyphenyl)-N4-(3-fluorophenyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N2-(4-ethoxyphenyl)-N4-(3-fluorophenyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N2-(4-ethoxyphenyl)-N4-(3-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 2-N-(4-ethoxyphenyl)-4-N-(3-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-6-(3-fluoroanilino)-5-nitro-pyrimidin-2-yl]-p-phenetyl-amine Formula: C18H17FN6O3 MolecularWeight: 384.364383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=C(C(=N2)NC3=CC(=CC=C3)F)[N+](=O)[O-])N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=C(C(=N2)NC3=CC(=CC=C3)F)[N+](=O)[O-])N

InChI

InChI=1S/C18H17FN6O3/c1-2-28-14-8-6-12(7-9-14)22-18-23-16(20)15(25(26)27)17(24-18)21-13-5-3-4-11(19)10-13/h3-10H,2H2,1H3,(H4,20,21,22,23,24)