[6-(dimethylamino)-5-nitro-pyrimidin-4-yl] thiocyanate

Systemtic Name: [6-(dimethylamino)-5-nitro-pyrimidin-4-yl] thiocyanate Openeye Name: [6-(dimethylamino)-5-nitro-pyrimidin-4-yl] thiocyanate CAS Name: thiocyanic acid [6-(dimethylamino)-5-nitro-4-pyrimidinyl] ester IUPAC Name: [6-(dimethylamino)-5-nitropyrimidin-4-yl] thiocyanate Traditional Name: thiocyanic acid [6-(dimethylamino)-5-nitro-pyrimidin-4-yl] ester Formula: C7H7N5O2S MolecularWeight: 225.22778

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C(=NC=N1)SC#N)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C(=NC=N1)SC#N)[N+](=O)[O-]

InChI

InChI=1S/C7H7N5O2S/c1-11(2)6-5(12(13)14)7(15-3-8)10-4-9-6/h4H,1-2H3