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

Systemtic Name: N4-butyl-N6-(4-methoxyphenyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-butyl-N6-(4-methoxyphenyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-butyl-N6-(4-methoxyphenyl)-N4-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-butyl-6-N-(4-methoxyphenyl)-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: butyl-methyl-[5-nitro-6-(p-anisidino)pyrimidin-4-yl]amine Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O3/c1-4-5-10-20(2)16-14(21(22)23)15(17-11-18-16)19-12-6-8-13(24-3)9-7-12/h6-9,11H,4-5,10H2,1-3H3,(H,17,18,19)