ethyl N-[2-[6-tert-butyl-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoyl]carbamate

Systemtic Name: ethyl N-[2-[6-tert-butyl-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoyl]carbamate Openeye Name: ethyl N-[2-[[6-tert-butyl-3-cyano-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetyl]carbamate CAS Name: N-[2-[[6-tert-butyl-3-cyano-4-(trifluoromethyl)-2-pyridinyl]thio]-1-oxoethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[6-tert-butyl-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetyl]carbamate Traditional Name: N-[2-[[6-tert-butyl-3-cyano-4-(trifluoromethyl)-2-pyridyl]thio]acetyl]carbamic acid ethyl ester Formula: C16H18F3N3O3S MolecularWeight: 389.39263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)CSC1=C(C(=CC(=N1)C(C)(C)C)C(F)(F)F)C#N

Isomeric SMILES

CCOC(=O)NC(=O)CSC1=C(C(=CC(=N1)C(C)(C)C)C(F)(F)F)C#N

InChI

InChI=1S/C16H18F3N3O3S/c1-5-25-14(24)22-12(23)8-26-13-9(7-20)10(16(17,18)19)6-11(21-13)15(2,3)4/h6H,5,8H2,1-4H3,(H,22,23,24)