methyl 2-(5-methylpyridin-2-yl)-3-sulfanylidene-1H-pyrazole-4-carboxylate

Systemtic Name: methyl 2-(5-methylpyridin-2-yl)-3-sulfanylidene-1H-pyrazole-4-carboxylate Openeye Name: methyl 2-(5-methyl-2-pyridyl)-3-thioxo-1H-pyrazole-4-carboxylate CAS Name: 2-(5-methyl-2-pyridinyl)-3-sulfanylidene-1H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-(5-methylpyridin-2-yl)-3-sulfanylidene-1H-pyrazole-4-carboxylate Traditional Name: 1-(5-methyl-2-pyridyl)-5-thioxo-3-pyrazoline-4-carboxylic acid methyl ester Formula: C11H11N3O2S MolecularWeight: 249.28894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=S)C(=CN2)C(=O)OC

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=S)C(=CN2)C(=O)OC

InChI

InChI=1S/C11H11N3O2S/c1-7-3-4-9(12-5-7)14-10(17)8(6-13-14)11(15)16-2/h3-6,13H,1-2H3