methyl 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate

Systemtic Name: methyl 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate Openeye Name: methyl 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate CAS Name: 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate Traditional Name: 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]propionic acid methyl ester Formula: C8H10F3N3O2S MolecularWeight: 269.24411

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=NN=C(N1C)C(F)(F)F

Isomeric SMILES

CC(C(=O)OC)SC1=NN=C(N1C)C(F)(F)F

InChI

InChI=1S/C8H10F3N3O2S/c1-4(5(15)16-3)17-7-13-12-6(14(7)2)8(9,10)11/h4H,1-3H3