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

Systemtic Name: N2-(2-methylpropyl)-5-nitro-6-pyrrolidin-1-yl-pyrimidine-2,4-diamine Openeye Name: N2-isobutyl-5-nitro-6-pyrrolidin-1-yl-pyrimidine-2,4-diamine CAS Name: N2-(2-methylpropyl)-5-nitro-6-(1-pyrrolidinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-(2-methylpropyl)-5-nitro-6-pyrrolidin-1-ylpyrimidine-2,4-diamine Traditional Name: (4-amino-5-nitro-6-pyrrolidino-pyrimidin-2-yl)-isobutyl-amine Formula: C12H20N6O2 MolecularWeight: 280.3262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCC2

Isomeric SMILES

CC(C)CNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCC2

InChI

InChI=1S/C12H20N6O2/c1-8(2)7-14-12-15-10(13)9(18(19)20)11(16-12)17-5-3-4-6-17/h8H,3-7H2,1-2H3,(H3,13,14,15,16)