N4,N6-dimethyl-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N4,N6-dimethyl-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4-benzyl-N4,N6-dimethyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4,N6-dimethyl-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-4-N,6-N-dimethyl-5-nitropyrimidine-4,6-diamine Traditional Name: benzyl-methyl-[6-(methylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C13H15N5O2 MolecularWeight: 273.2905

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=NC=N1)N(C)CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C(=NC=N1)N(C)CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O2/c1-14-12-11(18(19)20)13(16-9-15-12)17(2)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,14,15,16)