3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoic acid

Systemtic Name: 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoic acid Openeye Name: 3-[(4-methylthiazol-2-yl)sulfanylmethyl]benzoic acid CAS Name: 3-[[(4-methyl-2-thiazolyl)thio]methyl]benzoic acid IUPAC Name: 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoic acid Traditional Name: 3-[[(4-methylthiazol-2-yl)thio]methyl]benzoic acid Formula: C12H11NO2S2 MolecularWeight: 265.35124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=CC(=C2)C(=O)O

InChI

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