N2-(3,5-dimethoxyphenyl)-N4-methyl-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N2-(3,5-dimethoxyphenyl)-N4-methyl-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N2-(3,5-dimethoxyphenyl)-N4-methyl-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N2-(3,5-dimethoxyphenyl)-N4-methyl-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 2-N-(3,5-dimethoxyphenyl)-4-N-methyl-5-nitropyrimidine-2,4,6-triamine Traditional Name: [6-amino-2-(3,5-dimethoxyanilino)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C13H16N6O4 MolecularWeight: 320.30394

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC(=C1[N+](=O)[O-])N)NC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CNC1=NC(=NC(=C1[N+](=O)[O-])N)NC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C13H16N6O4/c1-15-12-10(19(20)21)11(14)17-13(18-12)16-7-4-8(22-2)6-9(5-7)23-3/h4-6H,1-3H3,(H4,14,15,16,17,18)