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

Systemtic Name: N4-butyl-N6-(2,4-dimethoxyphenyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-butyl-N6-(2,4-dimethoxyphenyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-butyl-N6-(2,4-dimethoxyphenyl)-N4-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-butyl-6-N-(2,4-dimethoxyphenyl)-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: butyl-[6-(2,4-dimethoxyanilino)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C17H23N5O4 MolecularWeight: 361.39562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C17H23N5O4/c1-5-6-9-21(2)17-15(22(23)24)16(18-11-19-17)20-13-8-7-12(25-3)10-14(13)26-4/h7-8,10-11H,5-6,9H2,1-4H3,(H,18,19,20)