methyl 2-(6-chloranylpyridin-2-yl)-3-sulfanylidene-1H-pyrazole-4-carboxylate

Systemtic Name: methyl 2-(6-chloranylpyridin-2-yl)-3-sulfanylidene-1H-pyrazole-4-carboxylate Openeye Name: methyl 2-(6-chloro-2-pyridyl)-3-thioxo-1H-pyrazole-4-carboxylate CAS Name: 2-(6-chloro-2-pyridinyl)-3-sulfanylidene-1H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-(6-chloropyridin-2-yl)-3-sulfanylidene-1H-pyrazole-4-carboxylate Traditional Name: 1-(6-chloro-2-pyridyl)-5-thioxo-3-pyrazoline-4-carboxylic acid methyl ester Formula: C10H8ClN3O2S MolecularWeight: 269.70742

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNN(C1=S)C2=NC(=CC=C2)Cl

Isomeric SMILES

COC(=O)C1=CNN(C1=S)C2=NC(=CC=C2)Cl

InChI

InChI=1S/C10H8ClN3O2S/c1-16-10(15)6-5-12-14(9(6)17)8-4-2-3-7(11)13-8/h2-5,12H,1H3