2-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-N-(4-methoxyphenyl)acetamide CAS Name: 2-[(5-cyano-6-methyl-2-phenyl-4-pyrimidinyl)thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-(5-cyano-6-methyl-2-phenylpyrimidin-4-yl)sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)thio]-N-(4-methoxyphenyl)acetamide Formula: C21H18N4O2S MolecularWeight: 390.45822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C21H18N4O2S/c1-14-18(12-22)21(25-20(23-14)15-6-4-3-5-7-15)28-13-19(26)24-16-8-10-17(27-2)11-9-16/h3-11H,13H2,1-2H3,(H,24,26)