2-(4-methylphenyl)sulfanyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-(4-methylphenyl)sulfanyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(p-tolylsulfanyl)thiazole-5-carboxylic acid CAS Name: 2-[(4-methylphenyl)thio]-5-thiazolecarboxylic acid IUPAC Name: 2-(4-methylphenyl)sulfanyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(p-tolylthio)thiazole-5-carboxylic acid Formula: C11H9NO2S2 MolecularWeight: 251.32466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=C(S2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=C(S2)C(=O)O

InChI

InChI=1S/C11H9NO2S2/c1-7-2-4-8(5-3-7)15-11-12-6-9(16-11)10(13)14/h2-6H,1H3,(H,13,14)