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

Systemtic Name: 5-[(4-fluorophenyl)-(1-methyl-2-methylsulfanyl-6-oxidanidyl-4-oxidanylidene-pyrimidin-5-yl)methyl]-3-methyl-2-methylsulfanyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 5-[(4-fluorophenyl)-(1-methyl-2-methylsulfanyl-6-oxido-4-oxo-pyrimidin-5-yl)methyl]-3-methyl-2-methylsulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 5-[(4-fluorophenyl)-[1-methyl-2-(methylthio)-6-oxido-4-oxo-5-pyrimidinyl]methyl]-3-methyl-2-(methylthio)-6-oxo-4-pyrimidinolate IUPAC Name: 5-[(4-fluorophenyl)-(1-methyl-2-methylsulfanyl-6-oxido-4-oxopyrimidin-5-yl)methyl]-3-methyl-2-methylsulfanyl-6-oxopyrimidin-4-olate Traditional Name: 5-[(4-fluorophenyl)-[4-keto-1-methyl-2-(methylthio)-6-oxido-pyrimidin-5-yl]methyl]-6-keto-3-methyl-2-(methylthio)pyrimidin-4-olate Formula: C19H17FN4O4S2-2 MolecularWeight: 448.491083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19FN4O4S2/c1-23-16(27)12(14(25)21-18(23)29-3)11(9-5-7-10(20)8-6-9)13-15(26)22-19(30-4)24(2)17(13)28/h5-8,11,27-28H,1-4H3/p-2