[2-(3,5-dimethylpyrazol-1-yl)-6-methyl-pyrimidin-4-yl] thiocyanate

Systemtic Name: [2-(3,5-dimethylpyrazol-1-yl)-6-methyl-pyrimidin-4-yl] thiocyanate Openeye Name: [2-(3,5-dimethylpyrazol-1-yl)-6-methyl-pyrimidin-4-yl] thiocyanate CAS Name: thiocyanic acid [2-(3,5-dimethyl-1-pyrazolyl)-6-methyl-4-pyrimidinyl] ester IUPAC Name: [2-(3,5-dimethylpyrazol-1-yl)-6-methylpyrimidin-4-yl] thiocyanate Traditional Name: thiocyanic acid [2-(3,5-dimethylpyrazol-1-yl)-6-methyl-pyrimidin-4-yl] ester Formula: C11H11N5S MolecularWeight: 245.30354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=CC(=N2)C)C)SC#N

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=CC(=N2)C)C)SC#N

InChI

InChI=1S/C11H11N5S/c1-7-5-10(17-6-12)14-11(13-7)16-9(3)4-8(2)15-16/h4-5H,1-3H3