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

Systemtic Name: 2-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-N-phenethyl-acetamide CAS Name: 2-[(5-cyano-6-methyl-2-phenyl-4-pyrimidinyl)thio]-N-phenethylacetamide IUPAC Name: 2-(5-cyano-6-methyl-2-phenylpyrimidin-4-yl)sulfanyl-N-phenethylacetamide Traditional Name: 2-[(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)thio]-N-phenethyl-acetamide Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCC(=O)NCCC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCC(=O)NCCC3=CC=CC=C3)C#N

InChI

InChI=1S/C22H20N4OS/c1-16-19(14-23)22(26-21(25-16)18-10-6-3-7-11-18)28-15-20(27)24-13-12-17-8-4-2-5-9-17/h2-11H,12-13,15H2,1H3,(H,24,27)