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

Systemtic Name: (2R)-2-(2-azanyl-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)oxy-3-methyl-N-[3-(trifluoromethyl)phenyl]butanamide Openeye Name: (2R)-2-(2-amino-5-cyano-6-methylsulfanyl-pyrimidin-4-yl)oxy-3-methyl-N-[3-(trifluoromethyl)phenyl]butanamide CAS Name: (2R)-2-[[2-amino-5-cyano-6-(methylthio)-4-pyrimidinyl]oxy]-3-methyl-N-[3-(trifluoromethyl)phenyl]butanamide IUPAC Name: (2R)-2-(2-amino-5-cyano-6-methylsulfanylpyrimidin-4-yl)oxy-3-methyl-N-[3-(trifluoromethyl)phenyl]butanamide Traditional Name: (2R)-2-[2-amino-5-cyano-6-(methylthio)pyrimidin-4-yl]oxy-3-methyl-N-[3-(trifluoromethyl)phenyl]butyramide Formula: C18H18F3N5O2S MolecularWeight: 425.42803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(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/C18H18F3N5O2S/c1-9(2)13(28-15-12(8-22)16(29-3)26-17(23)25-15)14(27)24-11-6-4-5-10(7-11)18(19,20)21/h4-7,9,13H,1-3H3,(H,24,27)(H2,23,25,26)/t13-/m1/s1