2-ethylsulfanyl-5-[(2-ethylsulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-(4-propan-2-ylphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-ethylsulfanyl-5-[(2-ethylsulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-(4-propan-2-ylphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-ethylsulfanyl-5-[(2-ethylsulfanyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)-(4-isopropylphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-(ethylthio)-5-[[2-(ethylthio)-4-hydroxy-6-oxo-1H-pyrimidin-5-yl]-(4-propan-2-ylphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one IUPAC Name: 2-ethylsulfanyl-5-[(2-ethylsulfanyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)-(4-propan-2-ylphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one Traditional Name: 2-(ethylthio)-5-[[2-(ethylthio)-4-hydroxy-6-keto-1H-pyrimidin-5-yl]-p-cumenyl-methyl]-4-hydroxy-1H-pyrimidin-6-one Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O4S2/c1-5-31-21-23-17(27)15(18(28)24-21)14(13-9-7-12(8-10-13)11(3)4)16-19(29)25-22(32-6-2)26-20(16)30/h7-11,14H,5-6H2,1-4H3,(H2,23,24,27,28)(H2,25,26,29,30)