2-[[4-(4-methylsulfanylphenyl)-5-phenyl-1,3-thiazol-2-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-(4-methylsulfanylphenyl)-5-phenyl-1,3-thiazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[4-(4-methylsulfanylphenyl)-5-phenyl-thiazol-2-yl]sulfanylacetic acid CAS Name: 2-[[4-[4-(methylthio)phenyl]-5-phenyl-2-thiazolyl]thio]acetic acid IUPAC Name: 2-[[4-(4-methylsulfanylphenyl)-5-phenyl-1,3-thiazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-[4-(methylthio)phenyl]-5-phenyl-thiazol-2-yl]thio]acetic acid Formula: C18H15NO2S3 MolecularWeight: 373.5122

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(SC(=N2)SCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(SC(=N2)SCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H15NO2S3/c1-22-14-9-7-12(8-10-14)16-17(13-5-3-2-4-6-13)24-18(19-16)23-11-15(20)21/h2-10H,11H2,1H3,(H,20,21)