5-[(3-methoxyphenyl)-(1-methyl-2-methylsulfanyl-6-oxidanidyl-4-oxidanylidene-pyrimidin-5-yl)methyl]-3-methyl-2-methylsulfanyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 5-[(3-methoxyphenyl)-(1-methyl-2-methylsulfanyl-6-oxidanidyl-4-oxidanylidene-pyrimidin-5-yl)methyl]-3-methyl-2-methylsulfanyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 5-[(3-methoxyphenyl)-(1-methyl-2-methylsulfanyl-6-oxido-4-oxo-pyrimidin-5-yl)methyl]-3-methyl-2-methylsulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 5-[(3-methoxyphenyl)-[1-methyl-2-(methylthio)-6-oxido-4-oxo-5-pyrimidinyl]methyl]-3-methyl-2-(methylthio)-6-oxo-4-pyrimidinolate IUPAC Name: 5-[(3-methoxyphenyl)-(1-methyl-2-methylsulfanyl-6-oxido-4-oxopyrimidin-5-yl)methyl]-3-methyl-2-methylsulfanyl-6-oxopyrimidin-4-olate Traditional Name: 6-keto-5-[[4-keto-1-methyl-2-(methylthio)-6-oxido-pyrimidin-5-yl]-(3-methoxyphenyl)methyl]-3-methyl-2-(methylthio)pyrimidin-4-olate Formula: C20H20N4O5S2-2 MolecularWeight: 460.5266

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N=C1SC)C(C2=CC(=CC=C2)OC)C3=C(N(C(=NC3=O)SC)C)[O-])[O-]

Isomeric SMILES

CN1C(=C(C(=O)N=C1SC)C(C2=CC(=CC=C2)OC)C3=C(N(C(=NC3=O)SC)C)[O-])[O-]

InChI

InChI=1S/C20H22N4O5S2/c1-23-17(27)13(15(25)21-19(23)30-4)12(10-7-6-8-11(9-10)29-3)14-16(26)22-20(31-5)24(2)18(14)28/h6-9,12,27-28H,1-5H3/p-2