JAK3 inhibitor VI   

GtoPdb Ligand ID: 5995

Synonyms: HMS3229G13
Compound class: Synthetic organic
Comment: Parent compound has PubChem CID 9947841.
2D Structure
Click here for structure editor
SMILES / InChI / InChIKey
Canonical SMILES CS(=O)(=O)O.O=C1Nc2c(C1=Cc1ccc[nH]1)cc(cc2)c1cccnc1
Isomeric SMILES CS(=O)(=O)O.O=C1Nc2c(/C/1=C/c1ccc[nH]1)cc(cc2)c1cccnc1
InChI InChI=1S/C18H13N3O.CH4O3S/c22-18-16(10-14-4-2-8-20-14)15-9-12(5-6-17(15)21-18)13-3-1-7-19-11-13;1-5(2,3)4/h1-11,20H,(H,21,22);1H3,(H,2,3,4)/b16-10-;
InChI Key ZUDPNBZMAJGYTE-HYMQDMCPSA-N
Classification
Compound class Synthetic organic
IUPAC Name
(3Z)-5-(pyridin-3-yl)-3-(1H-pyrrol-2-ylmethylidene)-2,3-dihydro-1H-indol-2-one; methanesulfonic acid
Synonyms
HMS3229G13
Database Links
CAS Registry No. 856436-16-3
ChEMBL Ligand CHEMBL2397013
GtoPdb PubChem SID 178102617
PubChem CID 16760524
Search Google for chemical match using the InChIKey ZUDPNBZMAJGYTE-HYMQDMCPSA-N
Search Google for chemicals with the same backbone ZUDPNBZMAJGYTE
Search UniChem for chemical match using the InChIKey ZUDPNBZMAJGYTE-HYMQDMCPSA-N
Search UniChem for chemicals with the same backbone ZUDPNBZMAJGYTE