2-methylsulfanyl-5-[(2-methylsulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-(3,4,5-trimethoxyphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-methylsulfanyl-5-[(2-methylsulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-(3,4,5-trimethoxyphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-5-[(4-hydroxy-2-methylsulfanyl-6-oxo-1H-pyrimidin-5-yl)-(3,4,5-trimethoxyphenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-[[4-hydroxy-2-(methylthio)-6-oxo-1H-pyrimidin-5-yl]-(3,4,5-trimethoxyphenyl)methyl]-2-(methylthio)-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-5-[(4-hydroxy-2-methylsulfanyl-6-oxo-1H-pyrimidin-5-yl)-(3,4,5-trimethoxyphenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-5-[[4-hydroxy-6-keto-2-(methylthio)-1H-pyrimidin-5-yl]-(3,4,5-trimethoxyphenyl)methyl]-2-(methylthio)-1H-pyrimidin-6-one Formula: C20H22N4O7S2 MolecularWeight: 494.54128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(C2=C(N=C(NC2=O)SC)O)C3=C(N=C(NC3=O)SC)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(C2=C(N=C(NC2=O)SC)O)C3=C(N=C(NC3=O)SC)O

InChI

InChI=1S/C20H22N4O7S2/c1-29-9-6-8(7-10(30-2)14(9)31-3)11(12-15(25)21-19(32-4)22-16(12)26)13-17(27)23-20(33-5)24-18(13)28/h6-7,11H,1-5H3,(H2,21,22,25,26)(H2,23,24,27,28)