2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[2-piperidino-5-(trifluoromethyl)phenyl]acetamide Formula: C20H23F3N4OS MolecularWeight: 424.48303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3)C

InChI

InChI=1S/C20H23F3N4OS/c1-13-10-14(2)25-19(24-13)29-12-18(28)26-16-11-15(20(21,22)23)6-7-17(16)27-8-4-3-5-9-27/h6-7,10-11H,3-5,8-9,12H2,1-2H3,(H,26,28)