(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl) thiocyanate

Systemtic Name: (3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl) thiocyanate Openeye Name: (3-methyl-5-oxo-1,2-dihydropyrazol-4-yl) thiocyanate CAS Name: thiocyanic acid (3-methyl-5-oxo-1,2-dihydropyrazol-4-yl) ester IUPAC Name: (3-methyl-5-oxo-1,2-dihydropyrazol-4-yl) thiocyanate Traditional Name: thiocyanic acid (3-keto-5-methyl-3-pyrazolin-4-yl) ester Formula: C5H5N3OS MolecularWeight: 155.1777

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)SC#N

Isomeric SMILES

CC1=C(C(=O)NN1)SC#N

InChI

InChI=1S/C5H5N3OS/c1-3-4(10-2-6)5(9)8-7-3/h1H3,(H2,7,8,9)