2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-[4-(3-methylphenoxy)phenyl]ethanamide

Systemtic Name: 2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-[4-(3-methylphenoxy)phenyl]ethanamide Openeye Name: 2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-[4-(3-methylphenoxy)phenyl]acetamide CAS Name: 2-[(5-cyano-2,6-dimethyl-4-pyrimidinyl)thio]-N-[4-(3-methylphenoxy)phenyl]acetamide IUPAC Name: 2-(5-cyano-2,6-dimethylpyrimidin-4-yl)sulfanyl-N-[4-(3-methylphenoxy)phenyl]acetamide Traditional Name: 2-[(5-cyano-2,6-dimethyl-pyrimidin-4-yl)thio]-N-[4-(3-methylphenoxy)phenyl]acetamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NC(=NC(=C3C#N)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NC(=NC(=C3C#N)C)C

InChI

InChI=1S/C22H20N4O2S/c1-14-5-4-6-19(11-14)28-18-9-7-17(8-10-18)26-21(27)13-29-22-20(12-23)15(2)24-16(3)25-22/h4-11H,13H2,1-3H3,(H,26,27)