ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1H-pyrazole-5-carboxylate Openeye Name: ethyl 4-(2-ethoxy-2-oxo-ethyl)sulfanyl-1H-pyrazole-5-carboxylate CAS Name: 4-[(2-ethoxy-2-oxoethyl)thio]-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-ethoxy-2-oxoethyl)sulfanyl-1H-pyrazole-5-carboxylate Traditional Name: 4-[(2-ethoxy-2-keto-ethyl)thio]-1H-pyrazole-5-carboxylic acid ethyl ester Formula: C10H14N2O4S MolecularWeight: 258.29416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(NN=C1)C(=O)OCC

Isomeric SMILES

CCOC(=O)CSC1=C(NN=C1)C(=O)OCC

InChI

InChI=1S/C10H14N2O4S/c1-3-15-8(13)6-17-7-5-11-12-9(7)10(14)16-4-2/h5H,3-4,6H2,1-2H3,(H,11,12)