5-nitro-N4-[(E)-quinolin-6-ylmethylideneamino]pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-[(E)-quinolin-6-ylmethylideneamino]pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4-[(E)-6-quinolylmethyleneamino]pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-[(E)-6-quinolinylmethylideneamino]pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-[(E)-quinolin-6-ylmethylideneamino]pyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-[(E)-6-quinolylmethyleneamino]amine Formula: C14H11N7O2 MolecularWeight: 309.28284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)C=NNC3=NC=NC(=C3[N+](=O)[O-])N)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2)/C=N/NC3=NC=NC(=C3[N+](=O)[O-])N)N=C1

InChI

InChI=1S/C14H11N7O2/c15-13-12(21(22)23)14(18-8-17-13)20-19-7-9-3-4-11-10(6-9)2-1-5-16-11/h1-8H,(H3,15,17,18,20)/b19-7+