(4-methyl-6-phenyl-pyrimidin-2-yl) thiocyanate

Systemtic Name: (4-methyl-6-phenyl-pyrimidin-2-yl) thiocyanate Openeye Name: (4-methyl-6-phenyl-pyrimidin-2-yl) thiocyanate CAS Name: thiocyanic acid (4-methyl-6-phenyl-2-pyrimidinyl) ester IUPAC Name: (4-methyl-6-phenylpyrimidin-2-yl) thiocyanate Traditional Name: thiocyanic acid (4-methyl-6-phenyl-pyrimidin-2-yl) ester Formula: C12H9N3S MolecularWeight: 227.28496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SC#N

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SC#N

InChI

InChI=1S/C12H9N3S/c1-9-7-11(10-5-3-2-4-6-10)15-12(14-9)16-8-13/h2-7H,1H3