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

Systemtic Name: 3-methyl-5-[(1-methyl-2-methylsulfanyl-6-oxidanidyl-4-oxidanylidene-pyrimidin-5-yl)-(4-methylphenyl)methyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 3-methyl-5-[(1-methyl-2-methylsulfanyl-6-oxido-4-oxo-pyrimidin-5-yl)-(p-tolyl)methyl]-2-methylsulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-methyl-5-[[1-methyl-2-(methylthio)-6-oxido-4-oxo-5-pyrimidinyl]-(4-methylphenyl)methyl]-2-(methylthio)-6-oxo-4-pyrimidinolate IUPAC Name: 3-methyl-5-[(1-methyl-2-methylsulfanyl-6-oxido-4-oxopyrimidin-5-yl)-(4-methylphenyl)methyl]-2-methylsulfanyl-6-oxopyrimidin-4-olate Traditional Name: 6-keto-5-[[4-keto-1-methyl-2-(methylthio)-6-oxido-pyrimidin-5-yl]-(p-tolyl)methyl]-3-methyl-2-(methylthio)pyrimidin-4-olate Formula: C20H20N4O4S2-2 MolecularWeight: 444.5272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=C(N(C(=NC2=O)SC)C)[O-])C3=C(N(C(=NC3=O)SC)C)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=C(N(C(=NC2=O)SC)C)[O-])C3=C(N(C(=NC3=O)SC)C)[O-]

InChI

InChI=1S/C20H22N4O4S2/c1-10-6-8-11(9-7-10)12(13-15(25)21-19(29-4)23(2)17(13)27)14-16(26)22-20(30-5)24(3)18(14)28/h6-9,12,27-28H,1-5H3/p-2