tert-butyl N-[2-sulfanyl-4-(trifluoromethyl)phenyl]carbamate

Systemtic Name: tert-butyl N-[2-sulfanyl-4-(trifluoromethyl)phenyl]carbamate Openeye Name: tert-butyl N-[2-sulfanyl-4-(trifluoromethyl)phenyl]carbamate CAS Name: N-[2-mercapto-4-(trifluoromethyl)phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-sulfanyl-4-(trifluoromethyl)phenyl]carbamate Traditional Name: N-[2-mercapto-4-(trifluoromethyl)phenyl]carbamic acid tert-butyl ester Formula: C12H14F3NO2S MolecularWeight: 293.30527

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)C(F)(F)F)S

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)C(F)(F)F)S

InChI

InChI=1S/C12H14F3NO2S/c1-11(2,3)18-10(17)16-8-5-4-7(6-9(8)19)12(13,14)15/h4-6,19H,1-3H3,(H,16,17)