O-ethyl 5-ethoxy-1H-pyrazole-4-carbothioate

Systemtic Name: O-ethyl 5-ethoxy-1H-pyrazole-4-carbothioate Openeye Name: O-ethyl 5-ethoxy-1H-pyrazole-4-carbothioate CAS Name: 5-ethoxy-1H-pyrazole-4-carbothioic acid O-ethyl ester IUPAC Name: O-ethyl 5-ethoxy-1H-pyrazole-4-carbothioate Traditional Name: 5-ethoxy-1H-pyrazole-4-carbothioic acid O-ethyl ester Formula: C8H12N2O2S MolecularWeight: 200.25808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=NN1)C(=S)OCC

Isomeric SMILES

CCOC1=C(C=NN1)C(=S)OCC

InChI

InChI=1S/C8H12N2O2S/c1-3-11-7-6(5-9-10-7)8(13)12-4-2/h5H,3-4H2,1-2H3,(H,9,10)