ethyl 2-[[5-(2-methylsulfanylpropan-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-(2-methylsulfanylpropan-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-(1-methyl-1-methylsulfanyl-ethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-[2-(methylthio)propan-2-yl]-1H-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(2-methylsulfanylpropan-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-[1-methyl-1-(methylthio)ethyl]-1H-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester Formula: C10H17N3O2S2 MolecularWeight: 275.39088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NNC(=N1)C(C)(C)SC

Isomeric SMILES

CCOC(=O)CSC1=NNC(=N1)C(C)(C)SC

InChI

InChI=1S/C10H17N3O2S2/c1-5-15-7(14)6-17-9-11-8(12-13-9)10(2,3)16-4/h5-6H2,1-4H3,(H,11,12,13)