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

Systemtic Name: [2-(cyclopentylamino)-2-oxidanylidene-ethyl] 2-[bis(fluoranyl)methylsulfanyl]pyridine-3-carboxylate Openeye Name: [2-(cyclopentylamino)-2-oxo-ethyl] 2-(difluoromethylsulfanyl)pyridine-3-carboxylate CAS Name: 2-(difluoromethylthio)-3-pyridinecarboxylic acid [2-(cyclopentylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylamino)-2-oxoethyl] 2-(difluoromethylsulfanyl)pyridine-3-carboxylate Traditional Name: 2-(difluoromethylthio)nicotinic acid [2-(cyclopentylamino)-2-keto-ethyl] ester Formula: C14H16F2N2O3S MolecularWeight: 330.350246

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)COC(=O)C2=C(N=CC=C2)SC(F)F

Isomeric SMILES

C1CCC(C1)NC(=O)COC(=O)C2=C(N=CC=C2)SC(F)F

InChI

InChI=1S/C14H16F2N2O3S/c15-14(16)22-12-10(6-3-7-17-12)13(20)21-8-11(19)18-9-4-1-2-5-9/h3,6-7,9,14H,1-2,4-5,8H2,(H,18,19)