Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L6PK0W
|
|||
| Ligand Name |
2-Chloro-4-{(2-Methylbenzyl)[(3s)-1-(Methylsulfonyl)pyrrolidin-3-Yl]amino}benzonitrile
|
|||
| Synonyms |
CHEMBL601500; 2-Chloro-4-{(2-Methylbenzyl)[(3s)-1-(Methylsulfonyl)pyrrolidin-3-Yl]amino}benzonitrile; 3kba; SCHEMBL3033639; BDBM50304974; Q27467321; (S)-2-chloro-4-((2-methylbenzyl)(1-(methylsulfonyl)pyrrolidin-3-yl)amino)benzonitrile; WOW
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C20H22ClN3O2S
|
|||
| Canonical SMILES |
CC1=CC=CC=C1CN(C2CCN(C2)S(=O)(=O)C)C3=CC(=C(C=C3)C#N)Cl
|
|||
| InChI |
1S/C20H22ClN3O2S/c1-15-5-3-4-6-17(15)13-24(18-8-7-16(12-22)20(21)11-18)19-9-10-23(14-19)27(2,25)26/h3-8,11,19H,9-10,13-14H2,1-2H3/t19-/m0/s1
|
|||
| InChIKey |
OTRAFCFYTZJLKH-IBGZPJMESA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.