Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L6U4MD
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| Ligand Name |
N-{(1s)-2-{4-[(5r)-1,1-Dioxido-3-Oxoisothiazolidin-5-Yl]phenyl}-1-[5-(Trifluoromethyl)-1h-Benzimidazol-2-Yl]ethyl}-2,2,2-Trifluoroacetamide
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| Synonyms |
N-{(1s)-2-{4-[(5r)-1,1-Dioxido-3-Oxoisothiazolidin-5-Yl]phenyl}-1-[5-(Trifluoromethyl)-1h-Benzimidazol-2-Yl]ethyl}-2,2,2-Trifluoroacetamide; 2cng; BDBM13474; Isothiazolidinone (IZD) deriv. 3; IZE; Q27461608; 2,2,2-trifluoro-N-[(1S)-1-[5-(trifluoromethyl)-1H-1,3-benzodiazol-2-yl]-2-{4-[(5S)-1,1,3-trioxo-1$l^{6},2-thiazolidin-5-yl]phenyl}ethyl]acetamide; N-{(1S)-2-[4-(1,1-dioxido-3-oxoisothiazolidin-5-yl)phenyl]-1-[5-(trifluoromethyl)-1H-benzimidazol-2-yl]ethyl}-2,2,2-trifluoroacetamide
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| Structure |
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Download2D MOL |
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| Formula |
C21H16F6N4O4S
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| Canonical SMILES |
C1C(S(=O)(=O)NC1=O)C2=CC=C(C=C2)CC(C3=NC4=C(N3)C=C(C=C4)C(F)(F)F)NC(=O)C(F)(F)F
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| InChI |
1S/C21H16F6N4O4S/c22-20(23,24)12-5-6-13-14(8-12)29-18(28-13)15(30-19(33)21(25,26)27)7-10-1-3-11(4-2-10)16-9-17(32)31-36(16,34)35/h1-6,8,15-16H,7,9H2,(H,28,29)(H,30,33)(H,31,32)/t15-,16-/m0/s1
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| InChIKey |
ZQCICORKZRLKMU-HOTGVXAUSA-N
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| PubChem Compound ID | ||||
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