tert-butyl N-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]carbamate

Systemtic Name: tert-butyl N-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]carbamate Openeye Name: tert-butyl N-[2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethyl]carbamate CAS Name: N-[2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]carbamate Traditional Name: N-[2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethyl]carbamic acid tert-butyl ester Formula: C13H17F3N2O2S MolecularWeight: 322.34649

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCSC1=NC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)NCCSC1=NC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C13H17F3N2O2S/c1-12(2,3)20-11(19)17-6-7-21-10-5-4-9(8-18-10)13(14,15)16/h4-5,8H,6-7H2,1-3H3,(H,17,19)