4-[bis(fluoranyl)methylsulfanyl]-5-(4-chlorophenyl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-5-(4-chlorophenyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 5-(4-chlorophenyl)-4-(difluoromethylsulfanyl)-1H-pyrrole-2-carboxylic acid CAS Name: 5-(4-chlorophenyl)-4-(difluoromethylthio)-1H-pyrrole-2-carboxylic acid IUPAC Name: 5-(4-chlorophenyl)-4-(difluoromethylsulfanyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-4-(difluoromethylthio)-1H-pyrrole-2-carboxylic acid Formula: C12H8ClF2NO2S MolecularWeight: 303.712226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=C(N2)C(=O)O)SC(F)F)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=C(N2)C(=O)O)SC(F)F)Cl

InChI

InChI=1S/C12H8ClF2NO2S/c13-7-3-1-6(2-4-7)10-9(19-12(14)15)5-8(16-10)11(17)18/h1-5,12,16H,(H,17,18)