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

Systemtic Name: 3-methyl-5-[(1-methyl-2-methylsulfanyl-6-oxidanidyl-4-oxidanylidene-pyrimidin-5-yl)-pyridin-2-yl-methyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 3-methyl-5-[(1-methyl-2-methylsulfanyl-6-oxido-4-oxo-pyrimidin-5-yl)-(2-pyridyl)methyl]-2-methylsulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-methyl-5-[[1-methyl-2-(methylthio)-6-oxido-4-oxo-5-pyrimidinyl]-(2-pyridinyl)methyl]-2-(methylthio)-6-oxo-4-pyrimidinolate IUPAC Name: 3-methyl-5-[(1-methyl-2-methylsulfanyl-6-oxido-4-oxopyrimidin-5-yl)-pyridin-2-ylmethyl]-2-methylsulfanyl-6-oxopyrimidin-4-olate Traditional Name: 6-keto-5-[[4-keto-1-methyl-2-(methylthio)-6-oxido-pyrimidin-5-yl]-(2-pyridyl)methyl]-3-methyl-2-(methylthio)pyrimidin-4-olate Formula: C18H17N5O4S2-2 MolecularWeight: 431.48868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N=C1SC)C(C2=CC=CC=N2)C3=C(N(C(=NC3=O)SC)C)[O-])[O-]

Isomeric SMILES

CN1C(=C(C(=O)N=C1SC)C(C2=CC=CC=N2)C3=C(N(C(=NC3=O)SC)C)[O-])[O-]

InChI

InChI=1S/C18H19N5O4S2/c1-22-15(26)11(13(24)20-17(22)28-3)10(9-7-5-6-8-19-9)12-14(25)21-18(29-4)23(2)16(12)27/h5-8,10,26-27H,1-4H3/p-2