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

Systemtic Name: N6-(2,4-dimethoxyphenyl)-N4-(2,5-dimethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(2,4-dimethoxyphenyl)-N4-(2,5-dimethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(2,4-dimethoxyphenyl)-N4-(2,5-dimethoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(2,4-dimethoxyphenyl)-4-N-(2,5-dimethoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2,4-dimethoxyanilino)-5-nitro-pyrimidin-4-yl]-(2,5-dimethoxyphenyl)amine Formula: C20H21N5O6 MolecularWeight: 427.41064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C20H21N5O6/c1-28-12-6-8-16(30-3)15(9-12)24-20-18(25(26)27)19(21-11-22-20)23-14-7-5-13(29-2)10-17(14)31-4/h5-11H,1-4H3,(H2,21,22,23,24)