Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L8M9BS
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| Ligand Name |
4-[(4r)-7-Methyl-2,5-Bis(Oxidanylidene)-1-[3-(Trifluoromethyl)phenyl]-3,4,6,8-Tetrahydropyrimido[4,5-D]pyridazin-4-Yl]benzenecarbonitrile
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| Synonyms |
4-[(4r)-7-Methyl-2,5-Bis(Oxidanylidene)-1-[3-(Trifluoromethyl)phenyl]-3,4,6,8-Tetrahydropyrimido[4,5-D]pyridazin-4-Yl]benzenecarbonitrile; SCHEMBL1134174; CHEMBL3642656; BDBM105225; S-BAY-8040; US8580800, 1; Q27461557; 4-{(4R)-7-Methyl-2,5-dioxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4,5,6,7,8-octahydropyrimido-[4,5-d]pyridazin-4-yl}benzonitrile; IUL
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| Structure |
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Download2D MOL |
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| Formula |
C21H16F3N5O2
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| Canonical SMILES |
CN1CC2=C(C(NC(=O)N2C3=CC=CC(=C3)C(F)(F)F)C4=CC=C(C=C4)C#N)C(=O)N1
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| InChI |
1S/C21H16F3N5O2/c1-28-11-16-17(19(30)27-28)18(13-7-5-12(10-25)6-8-13)26-20(31)29(16)15-4-2-3-14(9-15)21(22,23)24/h2-9,18H,11H2,1H3,(H,26,31)(H,27,30)/t18-/m1/s1
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| InChIKey |
UPNMBPLODWPJQQ-GOSISDBHSA-N
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| PubChem Compound ID | ||||
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