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

Systemtic Name: N2-(2,5-dimethoxyphenyl)-N4-(4-ethoxyphenyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N2-(2,5-dimethoxyphenyl)-N4-(4-ethoxyphenyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N2-(2,5-dimethoxyphenyl)-N4-(4-ethoxyphenyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 2-N-(2,5-dimethoxyphenyl)-4-N-(4-ethoxyphenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [6-amino-2-(2,5-dimethoxyanilino)-5-nitro-pyrimidin-4-yl]-p-phenetyl-amine Formula: C20H22N6O5 MolecularWeight: 426.42588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C20H22N6O5/c1-4-31-13-7-5-12(6-8-13)22-19-17(26(27)28)18(21)24-20(25-19)23-15-11-14(29-2)9-10-16(15)30-3/h5-11H,4H2,1-3H3,(H4,21,22,23,24,25)