Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LC0UR2
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| Ligand Name |
N-[(4S)-5-(4-chlorophenyl)-2-[N-cyano-N'-[3-(difluoromethoxy)phenyl]carbamimidoyl]-3,4-dihydropyrazol-4-yl]-N-ethyl-2-hydroxyacetamide
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| Structure |
 |
Download2D MOL |
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| Formula |
C22H21ClF2N6O3
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| Canonical SMILES |
CCN(C1CN(N=C1C2=CC=C(C=C2)Cl)C(=NC3=CC(=CC=C3)OC(F)F)NC#N)C(=O)CO
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| InChI |
1S/C22H21ClF2N6O3/c1-2-30(19(33)12-32)18-11-31(29-20(18)14-6-8-15(23)9-7-14)22(27-13-26)28-16-4-3-5-17(10-16)34-21(24)25/h3-10,18,21,32H,2,11-12H2,1H3,(H,27,28)/t18-/m0/s1
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| InChIKey |
GZPIECMFJJLDAB-SFHVURJKSA-N
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| PubChem Compound ID | ||||
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