N4-butan-2-yl-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-butan-2-yl-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-isopentyl-5-nitro-N4-sec-butyl-pyrimidine-4,6-diamine CAS Name: N4-butan-2-yl-N6-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-butan-2-yl-6-N-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine Traditional Name: isoamyl-[5-nitro-6-(sec-butylamino)pyrimidin-4-yl]amine Formula: C13H23N5O2 MolecularWeight: 281.35402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC=NC(=C1[N+](=O)[O-])NCCC(C)C

Isomeric SMILES

CCC(C)NC1=NC=NC(=C1[N+](=O)[O-])NCCC(C)C

InChI

InChI=1S/C13H23N5O2/c1-5-10(4)17-13-11(18(19)20)12(15-8-16-13)14-7-6-9(2)3/h8-10H,5-7H2,1-4H3,(H2,14,15,16,17)