[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]thio]acetic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetate Traditional Name: 2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]thio]acetic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C16H12F3N3O3S2 MolecularWeight: 415.40999

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)CSC1=C(C(=CC(=N1)C2=CC=CS2)C(F)(F)F)C#N

Isomeric SMILES

C[C@H](C(=O)N)OC(=O)CSC1=C(C(=CC(=N1)C2=CC=CS2)C(F)(F)F)C#N

InChI

InChI=1S/C16H12F3N3O3S2/c1-8(14(21)24)25-13(23)7-27-15-9(6-20)10(16(17,18)19)5-11(22-15)12-3-2-4-26-12/h2-5,8H,7H2,1H3,(H2,21,24)/t8-/m1/s1