Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L9WG8U
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| Ligand Name |
(4r)-4-(4-Cyanophenyl)-6-Methyl-2-Oxidanylidene-3-[2-Oxidanylidene-2-(4-Propan-2-Ylpiperazin-1-Yl)ethyl]-1-[3-(Trifluoromethyl)phenyl]-4h-Pyrimidine-5-Carbonitrile
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| Synonyms |
(4r)-4-(4-Cyanophenyl)-6-Methyl-2-Oxidanylidene-3-[2-Oxidanylidene-2-(4-Propan-2-Ylpiperazin-1-Yl)ethyl]-1-[3-(Trifluoromethyl)phenyl]-4h-Pyrimidine-5-Carbonitrile; Q27461714; JJX
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| Structure |
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Download2D MOL |
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| Formula |
C29H29F3N6O2
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| Canonical SMILES |
CC1=C(C(N(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)CC(=O)N3CCN(CC3)C(C)C)C4=CC=C(C=C4)C#N)C#N
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| InChI |
1S/C29H29F3N6O2/c1-19(2)35-11-13-36(14-12-35)26(39)18-37-27(22-9-7-21(16-33)8-10-22)25(17-34)20(3)38(28(37)40)24-6-4-5-23(15-24)29(30,31)32/h4-10,15,19,27H,11-14,18H2,1-3H3/t27-/m1/s1
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| InChIKey |
MJSBQGLWAKMDDF-HHHXNRCGSA-N
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| PubChem Compound ID | ||||
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