N-(2-chloranyl-4-pyrimidin-2-ylsulfanyl-phenyl)-3,3,3-tris(fluoranyl)-2-methyl-2-oxidanyl-propanamide

Systemtic Name: N-(2-chloranyl-4-pyrimidin-2-ylsulfanyl-phenyl)-3,3,3-tris(fluoranyl)-2-methyl-2-oxidanyl-propanamide Openeye Name: N-(2-chloro-4-pyrimidin-2-ylsulfanyl-phenyl)-3,3,3-trifluoro-2-hydroxy-2-methyl-propanamide CAS Name: N-[2-chloro-4-(2-pyrimidinylthio)phenyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide IUPAC Name: N-(2-chloro-4-pyrimidin-2-ylsulfanylphenyl)-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide Traditional Name: N-[2-chloro-4-(2-pyrimidylthio)phenyl]-3,3,3-trifluoro-2-hydroxy-2-methyl-propionamide Formula: C14H11ClF3N3O2S MolecularWeight: 377.76925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)SC2=NC=CC=N2)Cl)(C(F)(F)F)O

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)SC2=NC=CC=N2)Cl)(C(F)(F)F)O

InChI

InChI=1S/C14H11ClF3N3O2S/c1-13(23,14(16,17)18)11(22)21-10-4-3-8(7-9(10)15)24-12-19-5-2-6-20-12/h2-7,23H,1H3,(H,21,22)