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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(N1C)C2=CSC(=C2C)C

Isomeric SMILES

CCOC(=O)CSC1=NN=C(N1C)C2=CSC(=C2C)C

InChI

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