(2S)-3-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]butanoate

Systemtic Name: (2S)-3-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]butanoate Openeye Name: (2S)-3-methyl-2-(4-methylthiazol-2-yl)sulfanyl-butanoate CAS Name: (2S)-3-methyl-2-[(4-methyl-2-thiazolyl)thio]butanoate IUPAC Name: (2S)-3-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]butanoate Traditional Name: (2S)-3-methyl-2-[(4-methylthiazol-2-yl)thio]butyrate Formula: C9H12NO2S2- MolecularWeight: 230.32708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC(C(C)C)C(=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)S[C@@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C9H13NO2S2/c1-5(2)7(8(11)12)14-9-10-6(3)4-13-9/h4-5,7H,1-3H3,(H,11,12)/p-1/t7-/m0/s1