[2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-[bis(4-fluorophenyl)methylsulfanyl]ethanoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-[bis(4-fluorophenyl)methylsulfanyl]ethanoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 2-[bis(4-fluorophenyl)methylsulfanyl]acetate CAS Name: 2-[bis(4-fluorophenyl)methylthio]acetic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 2-[bis(4-fluorophenyl)methylsulfanyl]acetate Traditional Name: 2-[bis(4-fluorophenyl)methylthio]acetic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C21H23F2NO3S MolecularWeight: 407.474026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC(=O)CSC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)NC(=O)COC(=O)CSC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F

InChI

InChI=1S/C21H23F2NO3S/c1-21(2,3)24-18(25)12-27-19(26)13-28-20(14-4-8-16(22)9-5-14)15-6-10-17(23)11-7-15/h4-11,20H,12-13H2,1-3H3,(H,24,25)