(3-azanyl-3-oxidanylidene-propyl) 2-[bis(fluoranyl)methylsulfanyl]pyridine-3-carboxylate

Systemtic Name: (3-azanyl-3-oxidanylidene-propyl) 2-[bis(fluoranyl)methylsulfanyl]pyridine-3-carboxylate Openeye Name: (3-amino-3-oxo-propyl) 2-(difluoromethylsulfanyl)pyridine-3-carboxylate CAS Name: 2-(difluoromethylthio)-3-pyridinecarboxylic acid (3-amino-3-oxopropyl) ester IUPAC Name: (3-amino-3-oxopropyl) 2-(difluoromethylsulfanyl)pyridine-3-carboxylate Traditional Name: 2-(difluoromethylthio)nicotinic acid (3-amino-3-keto-propyl) ester Formula: C10H10F2N2O3S MolecularWeight: 276.259806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SC(F)F)C(=O)OCCC(=O)N

Isomeric SMILES

C1=CC(=C(N=C1)SC(F)F)C(=O)OCCC(=O)N

InChI

InChI=1S/C10H10F2N2O3S/c11-10(12)18-8-6(2-1-4-14-8)9(16)17-5-3-7(13)15/h1-2,4,10H,3,5H2,(H2,13,15)