[2-[3-cyano-6-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-phenyl-ethyl] carbamate

Systemtic Name: [2-[3-cyano-6-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-phenyl-ethyl] carbamate Openeye Name: [2-[[3-cyano-6-(trifluoromethyl)-2-pyridyl]sulfanyl]-2-phenyl-ethyl] carbamate CAS Name: carbamic acid [2-[[3-cyano-6-(trifluoromethyl)-2-pyridinyl]thio]-2-phenylethyl] ester IUPAC Name: [2-[3-cyano-6-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-phenylethyl] carbamate Traditional Name: carbamic acid [2-[[3-cyano-6-(trifluoromethyl)-2-pyridyl]thio]-2-phenyl-ethyl] ester Formula: C16H12F3N3O2S MolecularWeight: 367.34559

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(COC(=O)N)SC2=C(C=CC(=N2)C(F)(F)F)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(COC(=O)N)SC2=C(C=CC(=N2)C(F)(F)F)C#N

InChI

InChI=1S/C16H12F3N3O2S/c17-16(18,19)13-7-6-11(8-20)14(22-13)25-12(9-24-15(21)23)10-4-2-1-3-5-10/h1-7,12H,9H2,(H2,21,23)