2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(4-fluoranyl-3-methyl-phenyl)methyl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(4-fluoranyl-3-methyl-phenyl)methyl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(4-fluoro-3-methyl-phenyl)methyl]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[(4-fluoro-3-methylphenyl)methyl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(4-fluoro-3-methylphenyl)methyl]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(4-fluoro-3-methyl-benzyl)acetamide Formula: C16H18FN3OS MolecularWeight: 319.397023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NCC2=CC(=C(C=C2)F)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NCC2=CC(=C(C=C2)F)C)C

InChI

InChI=1S/C16H18FN3OS/c1-10-6-13(4-5-14(10)17)8-18-15(21)9-22-16-19-11(2)7-12(3)20-16/h4-7H,8-9H2,1-3H3,(H,18,21)