[2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-[bis(fluoranyl)methylsulfanyl]pyridine-3-carboxylate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-[bis(fluoranyl)methylsulfanyl]pyridine-3-carboxylate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] 2-(difluoromethylsulfanyl)pyridine-3-carboxylate CAS Name: 2-(difluoromethylthio)-3-pyridinecarboxylic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] 2-(difluoromethylsulfanyl)pyridine-3-carboxylate Traditional Name: 2-(difluoromethylthio)nicotinic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C12H12F2N2O3S MolecularWeight: 302.297086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)COC(=O)C2=C(N=CC=C2)SC(F)F

Isomeric SMILES

C1CC1NC(=O)COC(=O)C2=C(N=CC=C2)SC(F)F

InChI

InChI=1S/C12H12F2N2O3S/c13-12(14)20-10-8(2-1-5-15-10)11(18)19-6-9(17)16-7-3-4-7/h1-2,5,7,12H,3-4,6H2,(H,16,17)