N2-butyl-N4-methyl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-butyl-N4-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-butyl-N4-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-butyl-N4-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-butyl-4-N-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: butyl-[4-(methylamino)-5-nitro-pyrimidin-2-yl]amine Formula: C9H15N5O2 MolecularWeight: 225.2477

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=C(C(=N1)NC)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=NC=C(C(=N1)NC)[N+](=O)[O-]

InChI

InChI=1S/C9H15N5O2/c1-3-4-5-11-9-12-6-7(14(15)16)8(10-2)13-9/h6H,3-5H2,1-2H3,(H2,10,11,12,13)