N4,N6-dihexyl-2-methyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4,N6-dihexyl-2-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4,N6-dihexyl-2-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4,N6-dihexyl-2-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N,6-N-dihexyl-2-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: hexyl-[6-(hexylamino)-2-methyl-5-nitro-pyrimidin-4-yl]amine Formula: C17H31N5O2 MolecularWeight: 337.46034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=C(C(=NC(=N1)C)NCCCCCC)[N+](=O)[O-]

Isomeric SMILES

CCCCCCNC1=C(C(=NC(=N1)C)NCCCCCC)[N+](=O)[O-]

InChI

InChI=1S/C17H31N5O2/c1-4-6-8-10-12-18-16-15(22(23)24)17(21-14(3)20-16)19-13-11-9-7-5-2/h4-13H2,1-3H3,(H2,18,19,20,21)