3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxylate

Systemtic Name: 3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxylate Openeye Name: 3,5-bis(methylsulfanyl)isothiazole-4-carboxylate CAS Name: 3,5-bis(methylthio)-4-isothiazolecarboxylate IUPAC Name: 3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxylate Traditional Name: 3,5-bis(methylthio)isothiazole-4-carboxylate Formula: C6H6NO2S3- MolecularWeight: 220.31234

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=NS1)SC)C(=O)[O-]

Isomeric SMILES

CSC1=C(C(=NS1)SC)C(=O)[O-]

InChI

InChI=1S/C6H7NO2S3/c1-10-4-3(5(8)9)6(11-2)12-7-4/h1-2H3,(H,8,9)/p-1