ethyl 2-ethyl-3-sulfanylidene-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 2-ethyl-3-sulfanylidene-1H-pyrazole-4-carboxylate Openeye Name: ethyl 2-ethyl-3-thioxo-1H-pyrazole-4-carboxylate CAS Name: 2-ethyl-3-sulfanylidene-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-ethyl-3-sulfanylidene-1H-pyrazole-4-carboxylate Traditional Name: 1-ethyl-5-thioxo-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C8H12N2O2S MolecularWeight: 200.25808

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=S)C(=CN1)C(=O)OCC

Isomeric SMILES

CCN1C(=S)C(=CN1)C(=O)OCC

InChI

InChI=1S/C8H12N2O2S/c1-3-10-7(13)6(5-9-10)8(11)12-4-2/h5,9H,3-4H2,1-2H3