1-methyl-5-[(1-methyl-6-oxidanyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-5-yl)-[3-(trifluoromethyl)phenyl]methyl]-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-methyl-5-[(1-methyl-6-oxidanyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-5-yl)-[3-(trifluoromethyl)phenyl]methyl]-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 6-hydroxy-5-[(6-hydroxy-1-methyl-4-oxo-2-thioxo-pyrimidin-5-yl)-[3-(trifluoromethyl)phenyl]methyl]-1-methyl-2-thioxo-pyrimidin-4-one CAS Name: 6-hydroxy-5-[(6-hydroxy-1-methyl-4-oxo-2-sulfanylidene-5-pyrimidinyl)-[3-(trifluoromethyl)phenyl]methyl]-1-methyl-2-sulfanylidene-4-pyrimidinone IUPAC Name: 6-hydroxy-5-[(6-hydroxy-1-methyl-4-oxo-2-sulfanylidenepyrimidin-5-yl)-[3-(trifluoromethyl)phenyl]methyl]-1-methyl-2-sulfanylidenepyrimidin-4-one Traditional Name: 6-hydroxy-5-[(6-hydroxy-4-keto-1-methyl-2-thioxo-pyrimidin-5-yl)-[3-(trifluoromethyl)phenyl]methyl]-1-methyl-2-thioxo-pyrimidin-4-one Formula: C18H15F3N4O4S2 MolecularWeight: 472.46131

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)NC1=S)C(C2=CC(=CC=C2)C(F)(F)F)C3=C(N(C(=S)NC3=O)C)O)O

Isomeric SMILES

CN1C(=C(C(=O)NC1=S)C(C2=CC(=CC=C2)C(F)(F)F)C3=C(N(C(=S)NC3=O)C)O)O

InChI

InChI=1S/C18H15F3N4O4S2/c1-24-14(28)10(12(26)22-16(24)30)9(7-4-3-5-8(6-7)18(19,20)21)11-13(27)23-17(31)25(2)15(11)29/h3-6,9,28-29H,1-2H3,(H,22,26,30)(H,23,27,31)