2-[2-(2-iodanyl-4-methyl-phenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(2-iodanyl-4-methyl-phenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(2-iodo-4-methyl-phenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[2-(2-iodo-4-methylphenoxy)ethylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(2-iodo-4-methylphenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[2-(2-iodo-4-methyl-phenoxy)ethylthio]-6-methyl-1H-pyrimidin-4-one Formula: C14H15IN2O2S MolecularWeight: 402.25057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCSC2=NC(=O)C=C(N2)C)I

Isomeric SMILES

CC1=CC(=C(C=C1)OCCSC2=NC(=O)C=C(N2)C)I

InChI

InChI=1S/C14H15IN2O2S/c1-9-3-4-12(11(15)7-9)19-5-6-20-14-16-10(2)8-13(18)17-14/h3-4,7-8H,5-6H2,1-2H3,(H,16,17,18)