2-[(6-methylsulfanyl-1,4-dihydropyrimidin-3-ium-3-yl)methyl]-5-oxidanyl-1H-pyridin-4-one chloride hydrochloride

Systemtic Name: 2-[(6-methylsulfanyl-1,4-dihydropyrimidin-3-ium-3-yl)methyl]-5-oxidanyl-1H-pyridin-4-one chloride hydrochloride Openeye Name: 5-hydroxy-2-[(6-methylsulfanyl-1,4-dihydropyrimidin-3-ium-3-yl)methyl]-1H-pyridin-4-one chloride hydrochloride CAS Name: 5-hydroxy-2-[[6-(methylthio)-1,4-dihydropyrimidin-3-ium-3-yl]methyl]-1H-pyridin-4-one chloride hydrochloride IUPAC Name: 5-hydroxy-2-[(6-methylsulfanyl-1,4-dihydropyrimidin-3-ium-3-yl)methyl]-1H-pyridin-4-one chloride hydrochloride Traditional Name: 5-hydroxy-2-[[6-(methylthio)-1,4-dihydropyrimidin-3-ium-3-yl]methyl]-4-pyridone chloride hydrochloride Formula: C11H15Cl2N3O2S MolecularWeight: 324.2267

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC[N+](=CN1)CC2=CC(=O)C(=CN2)O.Cl.[Cl-]

Isomeric SMILES

CSC1=CC[N+](=CN1)CC2=CC(=O)C(=CN2)O.Cl.[Cl-]

InChI

InChI=1S/C11H13N3O2S.2ClH/c1-17-11-2-3-14(7-13-11)6-8-4-9(15)10(16)5-12-8;;/h2,4-5,7H,3,6H2,1H3,(H2,12,15,16);2*1H