[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 4-[bis(fluoranyl)methylsulfanyl]benzoate

Systemtic Name: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 4-[bis(fluoranyl)methylsulfanyl]benzoate Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] 4-(difluoromethylsulfanyl)benzoate CAS Name: 4-(difluoromethylthio)benzoic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 4-(difluoromethylsulfanyl)benzoate Traditional Name: 4-(difluoromethylthio)benzoic acid [2-(tert-amylamino)-2-keto-ethyl] ester Formula: C15H19F2NO3S MolecularWeight: 331.378066

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)COC(=O)C1=CC=C(C=C1)SC(F)F

Isomeric SMILES

CCC(C)(C)NC(=O)COC(=O)C1=CC=C(C=C1)SC(F)F

InChI

InChI=1S/C15H19F2NO3S/c1-4-15(2,3)18-12(19)9-21-13(20)10-5-7-11(8-6-10)22-14(16)17/h5-8,14H,4,9H2,1-3H3,(H,18,19)