2-[4-(trifluoromethylsulfanyl)phenyl]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[4-(trifluoromethylsulfanyl)phenyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-(trifluoromethylsulfanyl)phenyl]thiazole-5-carboxylic acid CAS Name: 2-[4-(trifluoromethylthio)phenyl]-5-thiazolecarboxylic acid IUPAC Name: 2-[4-(trifluoromethylsulfanyl)phenyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-(trifluoromethylthio)phenyl]thiazole-5-carboxylic acid Formula: C11H6F3NO2S2 MolecularWeight: 305.29605

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=C(S2)C(=O)O)SC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC=C(S2)C(=O)O)SC(F)(F)F

InChI

InChI=1S/C11H6F3NO2S2/c12-11(13,14)19-7-3-1-6(2-4-7)9-15-5-8(18-9)10(16)17/h1-5H,(H,16,17)