tert-butyl N-[[5-bromanyl-2-[4-methylsulfanyl-3-(trifluoromethyl)phenoxy]phenyl]methyl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[[5-bromanyl-2-[4-methylsulfanyl-3-(trifluoromethyl)phenoxy]phenyl]methyl]-N-methyl-carbamate Openeye Name: tert-butyl N-[[5-bromo-2-[4-methylsulfanyl-3-(trifluoromethyl)phenoxy]phenyl]methyl]-N-methyl-carbamate CAS Name: N-[[5-bromo-2-[4-(methylthio)-3-(trifluoromethyl)phenoxy]phenyl]methyl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[5-bromo-2-[4-methylsulfanyl-3-(trifluoromethyl)phenoxy]phenyl]methyl]-N-methylcarbamate Traditional Name: N-[5-bromo-2-[4-(methylthio)-3-(trifluoromethyl)phenoxy]benzyl]-N-methyl-carbamic acid tert-butyl ester Formula: C21H23BrF3NO3S MolecularWeight: 506.37643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)CC1=C(C=CC(=C1)Br)OC2=CC(=C(C=C2)SC)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N(C)CC1=C(C=CC(=C1)Br)OC2=CC(=C(C=C2)SC)C(F)(F)F

InChI

InChI=1S/C21H23BrF3NO3S/c1-20(2,3)29-19(27)26(4)12-13-10-14(22)6-8-17(13)28-15-7-9-18(30-5)16(11-15)21(23,24)25/h6-11H,12H2,1-5H3