5-nitro-N4-[(E)-(phenylmethylidene)amino]pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-[(E)-(phenylmethylidene)amino]pyrimidine-4,6-diamine Openeye Name: N4-[(E)-benzylideneamino]-5-nitro-pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-[(E)-(phenylmethylene)amino]pyrimidine-4,6-diamine IUPAC Name: 4-N-[(E)-benzylideneamino]-5-nitropyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-[(E)-benzalamino]amine Formula: C11H10N6O2 MolecularWeight: 258.2361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=NNC2=NC=NC(=C2[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)/C=N/NC2=NC=NC(=C2[N+](=O)[O-])N

InChI

InChI=1S/C11H10N6O2/c12-10-9(17(18)19)11(14-7-13-10)16-15-6-8-4-2-1-3-5-8/h1-7H,(H3,12,13,14,16)/b15-6+