methyl 2-(6-chloranylpyridin-2-yl)-5-methyl-3-sulfanylidene-1H-pyrazole-4-carboxylate

Systemtic Name: methyl 2-(6-chloranylpyridin-2-yl)-5-methyl-3-sulfanylidene-1H-pyrazole-4-carboxylate Openeye Name: methyl 2-(6-chloro-2-pyridyl)-5-methyl-3-thioxo-1H-pyrazole-4-carboxylate CAS Name: 2-(6-chloro-2-pyridinyl)-5-methyl-3-sulfanylidene-1H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-(6-chloropyridin-2-yl)-5-methyl-3-sulfanylidene-1H-pyrazole-4-carboxylate Traditional Name: 1-(6-chloro-2-pyridyl)-3-methyl-5-thioxo-3-pyrazoline-4-carboxylic acid methyl ester Formula: C11H10ClN3O2S MolecularWeight: 283.734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=S)N(N1)C2=NC(=CC=C2)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(=S)N(N1)C2=NC(=CC=C2)Cl)C(=O)OC

InChI

InChI=1S/C11H10ClN3O2S/c1-6-9(11(16)17-2)10(18)15(14-6)8-5-3-4-7(12)13-8/h3-5,14H,1-2H3