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

Systemtic Name: methyl 2-[[5-(4,5-dimethylthiophen-3-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[[5-(4,5-dimethyl-3-thienyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-(4,5-dimethyl-3-thiophenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[5-(4,5-dimethylthiophen-3-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-(4,5-dimethyl-3-thienyl)-4-ethyl-1,2,4-triazol-3-yl]thio]acetic acid methyl ester Formula: C13H17N3O2S2 MolecularWeight: 311.42298

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)OC)C2=CSC(=C2C)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)OC)C2=CSC(=C2C)C

InChI

InChI=1S/C13H17N3O2S2/c1-5-16-12(10-6-19-9(3)8(10)2)14-15-13(16)20-7-11(17)18-4/h6H,5,7H2,1-4H3