2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-iodanyl-2,6-dimethyl-phenyl)ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-iodanyl-2,6-dimethyl-phenyl)ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-iodo-2,6-dimethyl-phenyl)acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(4-iodo-2,6-dimethylphenyl)acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-iodo-2,6-dimethylphenyl)acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(4-iodo-2,6-dimethyl-phenyl)acetamide Formula: C16H18IN3OS MolecularWeight: 427.30309

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)CSC2=NC(=CC(=N2)C)C)C)I

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)CSC2=NC(=CC(=N2)C)C)C)I

InChI

InChI=1S/C16H18IN3OS/c1-9-5-13(17)6-10(2)15(9)20-14(21)8-22-16-18-11(3)7-12(4)19-16/h5-7H,8H2,1-4H3,(H,20,21)