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

Systemtic Name: N4-(2,4-dimethoxyphenyl)-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2,4-dimethoxyphenyl)-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2,4-dimethoxyphenyl)-N6-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2,4-dimethoxyphenyl)-6-N-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2,4-dimethoxyanilino)-5-nitro-pyrimidin-4-yl]-(2-ethylphenyl)amine Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=C(C=C(C=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=C(C=C(C=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O4/c1-4-13-7-5-6-8-15(13)23-19-18(25(26)27)20(22-12-21-19)24-16-10-9-14(28-2)11-17(16)29-3/h5-12H,4H2,1-3H3,(H2,21,22,23,24)