methyl 3-[(4,5-dimethyl-1,3-thiazol-2-yl)sulfanyl]propanoate

Systemtic Name: methyl 3-[(4,5-dimethyl-1,3-thiazol-2-yl)sulfanyl]propanoate Openeye Name: methyl 3-(4,5-dimethylthiazol-2-yl)sulfanylpropanoate CAS Name: 3-[(4,5-dimethyl-2-thiazolyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(4,5-dimethyl-1,3-thiazol-2-yl)sulfanyl]propanoate Traditional Name: 3-[(4,5-dimethylthiazol-2-yl)thio]propionic acid methyl ester Formula: C9H13NO2S2 MolecularWeight: 231.33502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCCC(=O)OC)C

Isomeric SMILES

CC1=C(SC(=N1)SCCC(=O)OC)C

InChI

InChI=1S/C9H13NO2S2/c1-6-7(2)14-9(10-6)13-5-4-8(11)12-3/h4-5H2,1-3H3