Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L40PBV
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| Ligand Name |
(~{E})-~{N}-(5-bromanyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enamide
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| Synonyms |
CHEMBL4798710; (~{E})-~{N}-(5-bromanyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enamide; BDBM50564385; K1B
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| Structure |
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Download2D MOL |
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| Formula |
C12H6BrN5O4S
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| Canonical SMILES |
C1=CC(=C(C=C1C=C(C#N)C(=O)NC2=NN=C(S2)Br)[N+](=O)[O-])O
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| InChI |
1S/C12H6BrN5O4S/c13-11-16-17-12(23-11)15-10(20)7(5-14)3-6-1-2-9(19)8(4-6)18(21)22/h1-4,19H,(H,15,17,20)/b7-3+
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| InChIKey |
PPZONJBKAANLPU-XVNBXDOJSA-N
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| PubChem Compound ID | ||||
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