N2-butyl-N2-methyl-6-morpholin-4-yl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-butyl-N2-methyl-6-morpholin-4-yl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-butyl-N2-methyl-6-morpholino-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-butyl-N2-methyl-6-(4-morpholinyl)-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-butyl-2-N-methyl-6-morpholin-4-yl-5-nitropyrimidine-2,4-diamine Traditional Name: (4-amino-6-morpholino-5-nitro-pyrimidin-2-yl)-butyl-methyl-amine Formula: C13H22N6O3 MolecularWeight: 310.35218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCOCC2

Isomeric SMILES

CCCCN(C)C1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCOCC2

InChI

InChI=1S/C13H22N6O3/c1-3-4-5-17(2)13-15-11(14)10(19(20)21)12(16-13)18-6-8-22-9-7-18/h3-9H2,1-2H3,(H2,14,15,16)