U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H20F3N5O3
Molecular Weight 447.4104
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Zotizalkib

SMILES

CC1(C)COC2=CC=C(F)C=C2CN3[C@@H](COC4=CN5N=CC(=C5N=C34)C(=O)N1)C(F)F

InChI

InChIKey=ILAMRXVQSGVCJX-AWEZNQCLSA-N
InChI=1S/C21H20F3N5O3/c1-21(2)10-32-15-4-3-12(22)5-11(15)7-28-14(17(23)24)9-31-16-8-29-18(26-19(16)28)13(6-25-29)20(30)27-21/h3-6,8,14,17H,7,9-10H2,1-2H3,(H,27,30)/t14-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Zotizalkib
INN  
Official Name English
TPX 0131 [WHO-DD]
Common Name English
18,1-METHENO-6H-(1,4)OXAZINO(3,4-I)PYRAZOLO(4,3-F)(1,4,8,10)BENZOXATRIAZACYCLOTRIDECIN-15(12H)-ONE, 4-(DIFLUOROMETHYL)-8-FLUORO-3,4,13,14-TETRAHYDRO-13,13-DIMETHYL-, (4S)-
Systematic Name English
1,18-METHENO-13H-(1,4)OXAZINO(3,4-I)PYRAZOLO(4,3-F)(1,4,8,10)BENZOXATRIAZACYCLOTRIDECIN-4(5H)-ONE, 15-(DIFLUOROMETHYL)-11-FLUORO-6,7,15,16-TETRAHYDRO-6,6-DIMETHYL-, (15S)-
Systematic Name English
zotizalkib [INN]
Common Name English
TPX0131
Code English
TPX-0131
Code English
Code System Code Type Description
INN
12458
Created by admin on Sat Dec 16 19:05:19 GMT 2023 , Edited by admin on Sat Dec 16 19:05:19 GMT 2023
PRIMARY
CAS
2648641-36-3
Created by admin on Sat Dec 16 19:05:19 GMT 2023 , Edited by admin on Sat Dec 16 19:05:19 GMT 2023
PRIMARY
PUBCHEM
156024486
Created by admin on Sat Dec 16 19:05:19 GMT 2023 , Edited by admin on Sat Dec 16 19:05:19 GMT 2023
PRIMARY
FDA UNII
5BKJ4Z6RBU
Created by admin on Sat Dec 16 19:05:19 GMT 2023 , Edited by admin on Sat Dec 16 19:05:19 GMT 2023
PRIMARY
NCI_THESAURUS
C180420
Created by admin on Sat Dec 16 19:05:19 GMT 2023 , Edited by admin on Sat Dec 16 19:05:19 GMT 2023
PRIMARY