methyl 3-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl]thio]propionic acid methyl ester Formula: C12H16O3S2 MolecularWeight: 272.38364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CSCCC(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CSCCC(=O)OC

InChI

InChI=1S/C12H16O3S2/c1-8-6-10(9(2)17-8)11(13)7-16-5-4-12(14)15-3/h6H,4-5,7H2,1-3H3