ethyl 5-(ethylsulfanylmethyl)-1H-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(ethylsulfanylmethyl)-1H-pyrazole-3-carboxylate Openeye Name: ethyl 5-(ethylsulfanylmethyl)-1H-pyrazole-3-carboxylate CAS Name: 5-[(ethylthio)methyl]-1H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(ethylsulfanylmethyl)-1H-pyrazole-3-carboxylate Traditional Name: 5-[(ethylthio)methyl]-1H-pyrazole-3-carboxylic acid ethyl ester Formula: C9H14N2O2S MolecularWeight: 214.28466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC(=C1)CSCC

Isomeric SMILES

CCOC(=O)C1=NNC(=C1)CSCC

InChI

InChI=1S/C9H14N2O2S/c1-3-13-9(12)8-5-7(10-11-8)6-14-4-2/h5H,3-4,6H2,1-2H3,(H,10,11)