N2-(2-methylpropyl)-5-nitro-6-piperidin-1-yl-pyrimidine-2,4-diamine

Systemtic Name: N2-(2-methylpropyl)-5-nitro-6-piperidin-1-yl-pyrimidine-2,4-diamine Openeye Name: N2-isobutyl-5-nitro-6-(1-piperidyl)pyrimidine-2,4-diamine CAS Name: N2-(2-methylpropyl)-5-nitro-6-(1-piperidinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-(2-methylpropyl)-5-nitro-6-piperidin-1-ylpyrimidine-2,4-diamine Traditional Name: (4-amino-5-nitro-6-piperidino-pyrimidin-2-yl)-isobutyl-amine Formula: C13H22N6O2 MolecularWeight: 294.35278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCCC2

Isomeric SMILES

CC(C)CNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCCC2

InChI

InChI=1S/C13H22N6O2/c1-9(2)8-15-13-16-11(14)10(19(20)21)12(17-13)18-6-4-3-5-7-18/h9H,3-8H2,1-2H3,(H3,14,15,16,17)