2-[(4-methylphenyl)sulfanylmethyl]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[(4-methylphenyl)sulfanylmethyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(p-tolylsulfanylmethyl)thiazole-5-carboxylic acid CAS Name: 2-[[(4-methylphenyl)thio]methyl]-5-thiazolecarboxylic acid IUPAC Name: 2-[(4-methylphenyl)sulfanylmethyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(p-tolylthio)methyl]thiazole-5-carboxylic acid Formula: C12H11NO2S2 MolecularWeight: 265.35124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=NC=C(S2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=NC=C(S2)C(=O)O

InChI

InChI=1S/C12H11NO2S2/c1-8-2-4-9(5-3-8)16-7-11-13-6-10(17-11)12(14)15/h2-6H,7H2,1H3,(H,14,15)