ethyl 2-[2-[2-(3,5-dimethylpyrazol-1-yl)ethylsulfanyl]ethylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(3,5-dimethylpyrazol-1-yl)ethylsulfanyl]ethylsulfanyl]ethanoate Openeye Name: ethyl 2-[2-[2-(3,5-dimethylpyrazol-1-yl)ethylsulfanyl]ethylsulfanyl]acetate CAS Name: 2-[2-[2-(3,5-dimethyl-1-pyrazolyl)ethylthio]ethylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(3,5-dimethylpyrazol-1-yl)ethylsulfanyl]ethylsulfanyl]acetate Traditional Name: 2-[2-[2-(3,5-dimethylpyrazol-1-yl)ethylthio]ethylthio]acetic acid ethyl ester Formula: C13H22N2O2S2 MolecularWeight: 302.45598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCCSCCN1C(=CC(=N1)C)C

Isomeric SMILES

CCOC(=O)CSCCSCCN1C(=CC(=N1)C)C

InChI

InChI=1S/C13H22N2O2S2/c1-4-17-13(16)10-19-8-7-18-6-5-15-12(3)9-11(2)14-15/h9H,4-8,10H2,1-3H3