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

Systemtic Name: 4-oxidanyl-5-[(4-oxidanyl-6-oxidanylidene-2-prop-2-enylsulfanyl-1H-pyrimidin-5-yl)-pyridin-4-yl-methyl]-2-prop-2-enylsulfanyl-1H-pyrimidin-6-one Openeye Name: 2-allylsulfanyl-5-[(2-allylsulfanyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)-(4-pyridyl)methyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-[[4-hydroxy-6-oxo-2-(prop-2-enylthio)-1H-pyrimidin-5-yl]-pyridin-4-ylmethyl]-2-(prop-2-enylthio)-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-5-[(4-hydroxy-6-oxo-2-prop-2-enylsulfanyl-1H-pyrimidin-5-yl)-pyridin-4-ylmethyl]-2-prop-2-enylsulfanyl-1H-pyrimidin-6-one Traditional Name: 2-(allylthio)-5-[[2-(allylthio)-4-hydroxy-6-keto-1H-pyrimidin-5-yl]-(4-pyridyl)methyl]-4-hydroxy-1H-pyrimidin-6-one Formula: C20H19N5O4S2 MolecularWeight: 457.52596

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC(=C(C(=O)N1)C(C2=CC=NC=C2)C3=C(N=C(NC3=O)SCC=C)O)O

Isomeric SMILES

C=CCSC1=NC(=C(C(=O)N1)C(C2=CC=NC=C2)C3=C(N=C(NC3=O)SCC=C)O)O

InChI

InChI=1S/C20H19N5O4S2/c1-3-9-30-19-22-15(26)13(16(27)23-19)12(11-5-7-21-8-6-11)14-17(28)24-20(25-18(14)29)31-10-4-2/h3-8,12H,1-2,9-10H2,(H2,22,23,26,27)(H2,24,25,28,29)