Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LA5V4X
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| Ligand Name |
N-(3-chloropyridin-4-yl)-2-{3-[3-(1-methyl-1H-pyrazol-4-yl)prop-2-yn-1-yl]-4-oxo-5-[(E)-2-sulfamoylethenyl]-3,4-dihydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl}acetamide
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| Synonyms |
N-(3-chloropyridin-4-yl)-2-{3-[3-(1-methyl-1H-pyrazol-4-yl)prop-2-yn-1-yl]-4-oxo-5-[(E)-2-sulfamoylethenyl]-3,4-dihydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl}acetamide
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| Structure |
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Download2D MOL |
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| Formula |
C22H19ClN8O4S
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| Canonical SMILES |
CN1C=C(C=N1)C#CCN2C=NC3=C(C2=O)C(=CN3CC(=O)NC4=C(C=NC=C4)Cl)C=CS(=O)(=O)N
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| InChI |
1S/C22H19ClN8O4S/c1-29-11-15(9-27-29)3-2-7-30-14-26-21-20(22(30)33)16(5-8-36(24,34)35)12-31(21)13-19(32)28-18-4-6-25-10-17(18)23/h4-6,8-12,14H,7,13H2,1H3,(H2,24,34,35)(H,25,28,32)/b8-5+
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| InChIKey |
OUCLSSBPFFIWNZ-VMPITWQZSA-N
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| PubChem Compound ID | ||||
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