(2R)-2-(2-azanyl-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)oxy-N-[3-(trifluoromethyl)phenyl]propanamide

Systemtic Name: (2R)-2-(2-azanyl-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)oxy-N-[3-(trifluoromethyl)phenyl]propanamide Openeye Name: (2R)-2-(2-amino-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)oxy-N-[3-(trifluoromethyl)phenyl]propanamide CAS Name: (2R)-2-[[2-amino-5-cyano-6-(methylthio)-4-pyrimidinyl]oxy]-N-[3-(trifluoromethyl)phenyl]propanamide IUPAC Name: (2R)-2-(2-amino-5-cyano-6-methylsulfanylpyrimidin-4-yl)oxy-N-[3-(trifluoromethyl)phenyl]propanamide Traditional Name: (2R)-2-[2-amino-5-cyano-6-(methylthio)pyrimidin-4-yl]oxy-N-[3-(trifluoromethyl)phenyl]propionamide Formula: C16H14F3N5O2S MolecularWeight: 397.37487

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)OC2=C(C(=NC(=N2)N)SC)C#N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C(F)(F)F)OC2=C(C(=NC(=N2)N)SC)C#N

InChI

InChI=1S/C16H14F3N5O2S/c1-8(26-13-11(7-20)14(27-2)24-15(21)23-13)12(25)22-10-5-3-4-9(6-10)16(17,18)19/h3-6,8H,1-2H3,(H,22,25)(H2,21,23,24)/t8-/m1/s1