N4-(2-ethoxyphenyl)-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(2-ethoxyphenyl)-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2-ethoxyphenyl)-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-ethoxyphenyl)-N6-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2-ethoxyphenyl)-6-N-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2-ethylanilino)-5-nitro-pyrimidin-4-yl]-o-phenetyl-amine Formula: C20H21N5O3 MolecularWeight: 379.41244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=CC=CC=C3OCC)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=CC=CC=C3OCC)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O3/c1-3-14-9-5-6-10-15(14)23-19-18(25(26)27)20(22-13-21-19)24-16-11-7-8-12-17(16)28-4-2/h5-13H,3-4H2,1-2H3,(H2,21,22,23,24)