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

Systemtic Name: methyl 2-[[5-(4,5-dimethylthiophen-3-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C12H15N3O2S2 MolecularWeight: 297.3964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1C2=NN=C(N2C)SCC(=O)OC)C

Isomeric SMILES

CC1=C(SC=C1C2=NN=C(N2C)SCC(=O)OC)C

InChI

InChI=1S/C12H15N3O2S2/c1-7-8(2)18-5-9(7)11-13-14-12(15(11)3)19-6-10(16)17-4/h5H,6H2,1-4H3