4-[[2,4-bis(fluoranyl)phenyl]sulfanylmethyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[[2,4-bis(fluoranyl)phenyl]sulfanylmethyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(2,4-difluorophenyl)sulfanylmethyl]thiazole-2-carboxylic acid CAS Name: 4-[[(2,4-difluorophenyl)thio]methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(2,4-difluorophenyl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[[(2,4-difluorophenyl)thio]methyl]thiazole-2-carboxylic acid Formula: C11H7F2NO2S2 MolecularWeight: 287.305586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)F)SCC2=CSC(=N2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1F)F)SCC2=CSC(=N2)C(=O)O

InChI

InChI=1S/C11H7F2NO2S2/c12-6-1-2-9(8(13)3-6)17-4-7-5-18-10(14-7)11(15)16/h1-3,5H,4H2,(H,15,16)