N-(3-chlorophenyl)-2-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chlorophenyl)-2-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(3-chlorophenyl)-2-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(3-chlorophenyl)-2-[(5-cyano-6-methyl-2-phenyl-4-pyrimidinyl)thio]acetamide IUPAC Name: N-(3-chlorophenyl)-2-(5-cyano-6-methyl-2-phenylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(3-chlorophenyl)-2-[(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)thio]acetamide Formula: C20H15ClN4OS MolecularWeight: 394.8773

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15ClN4OS/c1-13-17(11-22)20(25-19(23-13)14-6-3-2-4-7-14)27-12-18(26)24-16-9-5-8-15(21)10-16/h2-10H,12H2,1H3,(H,24,26)