tert-butyl 5-methyl-2-methylsulfanyl-1,3-thiazol-3-ium-3-carboxylate iodide

Systemtic Name: tert-butyl 5-methyl-2-methylsulfanyl-1,3-thiazol-3-ium-3-carboxylate iodide Openeye Name: tert-butyl 5-methyl-2-methylsulfanyl-thiazol-3-ium-3-carboxylate iodide CAS Name: 5-methyl-2-(methylthio)-3-thiazol-3-iumcarboxylic acid tert-butyl ester iodide IUPAC Name: tert-butyl 5-methyl-2-methylsulfanyl-1,3-thiazol-3-ium-3-carboxylate iodide Traditional Name: 5-methyl-2-(methylthio)thiazol-3-ium-3-carboxylic acid tert-butyl ester iodide Formula: C10H16INO2S2 MolecularWeight: 373.27401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=C(S1)SC)C(=O)OC(C)(C)C.[I-]

Isomeric SMILES

CC1=C[N+](=C(S1)SC)C(=O)OC(C)(C)C.[I-]

InChI

InChI=1S/C10H16NO2S2.HI/c1-7-6-11(9(14-5)15-7)8(12)13-10(2,3)4;/h6H,1-5H3;1H/q+1;/p-1