1,3-dimethyl-4-methylsulfanyl-pyrimidin-1-ium-2-one

Systemtic Name: 1,3-dimethyl-4-methylsulfanyl-pyrimidin-1-ium-2-one Openeye Name: 1,3-dimethyl-4-methylsulfanyl-pyrimidin-1-ium-2-one CAS Name: 1,3-dimethyl-4-(methylthio)-2-pyrimidin-1-iumone IUPAC Name: 1,3-dimethyl-4-methylsulfanylpyrimidin-1-ium-2-one Traditional Name: 1,3-dimethyl-4-(methylthio)pyrimidin-1-ium-2-one Formula: C7H11N2OS+ MolecularWeight: 171.24004

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=[N+](C1=O)C)SC

Isomeric SMILES

CN1C(=CC=[N+](C1=O)C)SC

InChI

InChI=1S/C7H11N2OS/c1-8-5-4-6(11-3)9(2)7(8)10/h4-5H,1-3H3/q+1