4-oxidanyl-5-[4-oxidanyl-6-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-one

Systemtic Name: 4-oxidanyl-5-[4-oxidanyl-6-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-one Openeye Name: 2-benzylsulfanyl-5-(2-benzylsulfanyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)-4-hydroxy-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-[4-hydroxy-6-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]-2-(phenylmethylthio)-1H-pyrimidin-6-one IUPAC Name: 2-benzylsulfanyl-5-(2-benzylsulfanyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)-4-hydroxy-1H-pyrimidin-6-one Traditional Name: 2-(benzylthio)-5-[2-(benzylthio)-4-hydroxy-6-keto-1H-pyrimidin-5-yl]-4-hydroxy-1H-pyrimidin-6-one Formula: C22H18N4O4S2 MolecularWeight: 466.53272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=C(C(=O)N2)C3=C(N=C(NC3=O)SCC4=CC=CC=C4)O)O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=C(C(=O)N2)C3=C(N=C(NC3=O)SCC4=CC=CC=C4)O)O

InChI

InChI=1S/C22H18N4O4S2/c27-17-15(18(28)24-21(23-17)31-11-13-7-3-1-4-8-13)16-19(29)25-22(26-20(16)30)32-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,23,24,27,28)(H2,25,26,29,30)