[4-(diethylcarbamothioylsulfanyl)-2-methyl-pentan-2-yl] 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: [4-(diethylcarbamothioylsulfanyl)-2-methyl-pentan-2-yl] 2,2,2-tris(fluoranyl)ethanoate Openeye Name: [3-(diethylcarbamothioylsulfanyl)-1,1-dimethyl-butyl] 2,2,2-trifluoroacetate CAS Name: 2,2,2-trifluoroacetic acid [4-[[diethylamino(sulfanylidene)methyl]thio]-2-methylpentan-2-yl] ester IUPAC Name: [4-(diethylcarbamothioylsulfanyl)-2-methylpentan-2-yl] 2,2,2-trifluoroacetate Traditional Name: 2,2,2-trifluoroacetic acid [3-(diethylthiocarbamoylthio)-1,1-dimethyl-butyl] ester Formula: C13H22F3NO2S2 MolecularWeight: 345.44449

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC(C)CC(C)(C)OC(=O)C(F)(F)F

Isomeric SMILES

CCN(CC)C(=S)SC(C)CC(C)(C)OC(=O)C(F)(F)F

InChI

InChI=1S/C13H22F3NO2S2/c1-6-17(7-2)11(20)21-9(3)8-12(4,5)19-10(18)13(14,15)16/h9H,6-8H2,1-5H3