2-methylsulfanyl-5-[(2-methylsulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-(4-prop-2-enoxyphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-methylsulfanyl-5-[(2-methylsulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-(4-prop-2-enoxyphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 5-[(4-allyloxyphenyl)-(4-hydroxy-2-methylsulfanyl-6-oxo-1H-pyrimidin-5-yl)methyl]-4-hydroxy-2-methylsulfanyl-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-[[4-hydroxy-2-(methylthio)-6-oxo-1H-pyrimidin-5-yl]-(4-prop-2-enoxyphenyl)methyl]-2-(methylthio)-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-5-[(4-hydroxy-2-methylsulfanyl-6-oxo-1H-pyrimidin-5-yl)-(4-prop-2-enoxyphenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-6-one Traditional Name: 5-[(4-allyloxyphenyl)-[4-hydroxy-6-keto-2-(methylthio)-1H-pyrimidin-5-yl]methyl]-4-hydroxy-2-(methylthio)-1H-pyrimidin-6-one Formula: C20H20N4O5S2 MolecularWeight: 460.5266

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=O)N1)C(C2=CC=C(C=C2)OCC=C)C3=C(N=C(NC3=O)SC)O)O

Isomeric SMILES

CSC1=NC(=C(C(=O)N1)C(C2=CC=C(C=C2)OCC=C)C3=C(N=C(NC3=O)SC)O)O

InChI

InChI=1S/C20H20N4O5S2/c1-4-9-29-11-7-5-10(6-8-11)12(13-15(25)21-19(30-2)22-16(13)26)14-17(27)23-20(31-3)24-18(14)28/h4-8,12H,1,9H2,2-3H3,(H2,21,22,25,26)(H2,23,24,27,28)