N-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propionamide Formula: C17H17ClF3N3OS MolecularWeight: 403.84959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C17H17ClF3N3OS/c1-9-12(10(2)23-16(22-9)26-3)5-7-15(25)24-11-4-6-14(18)13(8-11)17(19,20)21/h4,6,8H,5,7H2,1-3H3,(H,24,25)