N4,6-dimethyl-5-nitro-N4-phenyl-pyrimidine-2,4-diamine

Systemtic Name: N4,6-dimethyl-5-nitro-N4-phenyl-pyrimidine-2,4-diamine Openeye Name: N4,6-dimethyl-5-nitro-N4-phenyl-pyrimidine-2,4-diamine CAS Name: N4,6-dimethyl-5-nitro-N4-phenylpyrimidine-2,4-diamine IUPAC Name: 4-N,6-dimethyl-5-nitro-4-N-phenylpyrimidine-2,4-diamine Traditional Name: (2-amino-6-methyl-5-nitro-pyrimidin-4-yl)-methyl-phenyl-amine Formula: C12H13N5O2 MolecularWeight: 259.26392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N)N(C)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)N)N(C)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O2/c1-8-10(17(18)19)11(15-12(13)14-8)16(2)9-6-4-3-5-7-9/h3-7H,1-2H3,(H2,13,14,15)