[1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2-[bis(fluoranyl)methylsulfanyl]pyridine-3-carboxylate

Systemtic Name: [1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2-[bis(fluoranyl)methylsulfanyl]pyridine-3-carboxylate Openeye Name: [2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl] 2-(difluoromethylsulfanyl)pyridine-3-carboxylate CAS Name: 2-(difluoromethylthio)-3-pyridinecarboxylic acid [1-(ethylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 2-(difluoromethylsulfanyl)pyridine-3-carboxylate Traditional Name: 2-(difluoromethylthio)nicotinic acid [2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C13H15F2N3O4S MolecularWeight: 347.337706

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)OC(=O)C1=C(N=CC=C1)SC(F)F

Isomeric SMILES

CCNC(=O)NC(=O)C(C)OC(=O)C1=C(N=CC=C1)SC(F)F

InChI

InChI=1S/C13H15F2N3O4S/c1-3-16-13(21)18-9(19)7(2)22-11(20)8-5-4-6-17-10(8)23-12(14)15/h4-7,12H,3H2,1-2H3,(H2,16,18,19,21)