N-(3-iodanyl-4-methyl-phenyl)-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-(3-iodo-4-methyl-phenyl)-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-(3-iodo-4-methylphenyl)-3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-(3-iodo-4-methylphenyl)-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-(3-iodo-4-methyl-phenyl)-3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]propionamide Formula: C16H18IN3O2S MolecularWeight: 443.30249

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC2=C(NC(=NC2=O)SC)C)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC2=C(NC(=NC2=O)SC)C)I

InChI

InChI=1S/C16H18IN3O2S/c1-9-4-5-11(8-13(9)17)19-14(21)7-6-12-10(2)18-16(23-3)20-15(12)22/h4-5,8H,6-7H2,1-3H3,(H,19,21)(H,18,20,22)