Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L15BAU
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| Ligand Name |
(~{E})-~{N}-(5-~{tert}-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enamide
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| Synonyms |
CHEMBL4778120; (~{E})-~{N}-(5-~{tert}-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enamide; BDBM50564381; K0N
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| Structure |
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Download2D MOL |
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| Formula |
C17H18N4O3S
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| Canonical SMILES |
CC(C)(C)C1=NN=C(S1)NC(=O)C(=CC2=CC(=C(C=C2)O)OC)C#N
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| InChI |
1S/C17H18N4O3S/c1-17(2,3)15-20-21-16(25-15)19-14(23)11(9-18)7-10-5-6-12(22)13(8-10)24-4/h5-8,22H,1-4H3,(H,19,21,23)/b11-7+
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| InChIKey |
QETDAIRBSSGKBC-YRNVUSSQSA-N
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| PubChem Compound ID | ||||
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