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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNN(C1=S)C2=C(C=CC=N2)Cl

Isomeric SMILES

CCOC(=O)C1=CNN(C1=S)C2=C(C=CC=N2)Cl

InChI

InChI=1S/C11H10ClN3O2S/c1-2-17-11(16)7-6-14-15(10(7)18)9-8(12)4-3-5-13-9/h3-6,14H,2H2,1H3