[1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] 4-(trifluoromethylsulfanyl)benzoate

Systemtic Name: [1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] 4-(trifluoromethylsulfanyl)benzoate Openeye Name: [2-(cyclopentylamino)-1-methyl-2-oxo-ethyl] 4-(trifluoromethylsulfanyl)benzoate CAS Name: 4-(trifluoromethylthio)benzoic acid [1-(cyclopentylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopentylamino)-1-oxopropan-2-yl] 4-(trifluoromethylsulfanyl)benzoate Traditional Name: 4-(trifluoromethylthio)benzoic acid [2-(cyclopentylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H18F3NO3S MolecularWeight: 361.37923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)OC(=O)C2=CC=C(C=C2)SC(F)(F)F

Isomeric SMILES

CC(C(=O)NC1CCCC1)OC(=O)C2=CC=C(C=C2)SC(F)(F)F

InChI

InChI=1S/C16H18F3NO3S/c1-10(14(21)20-12-4-2-3-5-12)23-15(22)11-6-8-13(9-7-11)24-16(17,18)19/h6-10,12H,2-5H2,1H3,(H,20,21)