5-iodanyl-3,6-dimethyl-2-methylsulfanyl-pyrimidin-4-one

Systemtic Name: 5-iodanyl-3,6-dimethyl-2-methylsulfanyl-pyrimidin-4-one Openeye Name: 5-iodo-3,6-dimethyl-2-methylsulfanyl-pyrimidin-4-one CAS Name: 5-iodo-3,6-dimethyl-2-(methylthio)-4-pyrimidinone IUPAC Name: 5-iodo-3,6-dimethyl-2-methylsulfanylpyrimidin-4-one Traditional Name: 5-iodo-3,6-dimethyl-2-(methylthio)pyrimidin-4-one Formula: C7H9IN2OS MolecularWeight: 296.12863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SC)C)I

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SC)C)I

InChI

InChI=1S/C7H9IN2OS/c1-4-5(8)6(11)10(2)7(9-4)12-3/h1-3H3