4-[(4-propan-2-ylphenyl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(4-propan-2-ylphenyl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(4-isopropylphenyl)sulfanylmethyl]thiazole-2-carboxylic acid CAS Name: 4-[[(4-propan-2-ylphenyl)thio]methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(4-propan-2-ylphenyl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(p-cumenylthio)methyl]thiazole-2-carboxylic acid Formula: C14H15NO2S2 MolecularWeight: 293.4044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SCC2=CSC(=N2)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SCC2=CSC(=N2)C(=O)O

InChI

InChI=1S/C14H15NO2S2/c1-9(2)10-3-5-12(6-4-10)18-7-11-8-19-13(15-11)14(16)17/h3-6,8-9H,7H2,1-2H3,(H,16,17)