Ligand Information
Ligand General Information | Top | |||
---|---|---|---|---|
Ligand ID |
L4CS3J
|
|||
Ligand Name |
(2~{S})-1-[2,4-bis(chloranyl)-3-[[4-imidazol-1-yl-2-(trifluoromethyl)quinolin-8-yl]oxymethyl]phenyl]sulfonyl-~{N}-methyl-pyrrolidine-2-carboxamide
|
|||
Synonyms |
CHEMBL4787298; (2~{S})-1-[2,4-bis(chloranyl)-3-[[4-imidazol-1-yl-2-(trifluoromethyl)quinolin-8-yl]oxymethyl]phenyl]sulfonyl-~{N}-methyl-pyrrolidine-2-carboxamide; BDBM50546016; HBW
Click to Show/Hide
|
|||
Structure |
![]() |
Download2D MOL |
||
Formula |
C26H22Cl2F3N5O4S
|
|||
Canonical SMILES |
CNC(=O)C1CCCN1S(=O)(=O)C2=C(C(=C(C=C2)Cl)COC3=CC=CC4=C3N=C(C=C4N5C=CN=C5)C(F)(F)F)Cl
|
|||
InChI |
1S/C26H22Cl2F3N5O4S/c1-32-25(37)18-5-3-10-36(18)41(38,39)21-8-7-17(27)16(23(21)28)13-40-20-6-2-4-15-19(35-11-9-33-14-35)12-22(26(29,30)31)34-24(15)20/h2,4,6-9,11-12,14,18H,3,5,10,13H2,1H3,(H,32,37)/t18-/m0/s1
|
|||
InChIKey |
YPZVBDHGFDAMKP-SFHVURJKSA-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.