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

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[3-(2-thiophen-2-ylethynyl)phenyl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[3-[2-(2-thienyl)ethynyl]phenyl]acetamide Formula: C20H17N3OS2 MolecularWeight: 379.49848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)C

InChI

InChI=1S/C20H17N3OS2/c1-14-11-15(2)22-20(21-14)26-13-19(24)23-17-6-3-5-16(12-17)8-9-18-7-4-10-25-18/h3-7,10-12H,13H2,1-2H3,(H,23,24)