N2-ethyl-5-nitro-N4-phenyl-pyrimidine-2,4-diamine

Systemtic Name: N2-ethyl-5-nitro-N4-phenyl-pyrimidine-2,4-diamine Openeye Name: N2-ethyl-5-nitro-N4-phenyl-pyrimidine-2,4-diamine CAS Name: N2-ethyl-5-nitro-N4-phenylpyrimidine-2,4-diamine IUPAC Name: 2-N-ethyl-5-nitro-4-N-phenylpyrimidine-2,4-diamine Traditional Name: (4-anilino-5-nitro-pyrimidin-2-yl)-ethyl-amine Formula: C12H13N5O2 MolecularWeight: 259.26392

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=C(C(=N1)NC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCNC1=NC=C(C(=N1)NC2=CC=CC=C2)[N+](=O)[O-]

InChI

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