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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H29N5O3
Molecular Weight 471.5509
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZANUBRUTINIB

SMILES

NC(=O)C1=C2NCC[C@@H](C3CCN(CC3)C(=O)C=C)N2N=C1C4=CC=C(OC5=CC=CC=C5)C=C4

InChI

InChIKey=RNOAOAWBMHREKO-QFIPXVFZSA-N
InChI=1S/C27H29N5O3/c1-2-23(33)31-16-13-18(14-17-31)22-12-15-29-27-24(26(28)34)25(30-32(22)27)19-8-10-21(11-9-19)35-20-6-4-3-5-7-20/h2-11,18,22,29H,1,12-17H2,(H2,28,34)/t22-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ZANUBRUTINIB
INN   USAN  
Official Name English
ZANUBRUTINIB [WHO-DD]
Common Name English
PYRAZOLO(1,5-A)PYRIMIDINE-3-CARBOXAMIDE, 4,5,6,7-TETRAHYDRO-7-(1-(1-OXO-2-PROPEN-1-YL)-4-PIPERIDINYL)-2-(4-PHENOXYPHENYL)-, (7S)-
Systematic Name English
ZANUBRUTINIB [USAN]
Common Name English
BGB-3111
Code English
(7S)-2-(4-PHENOXYPHENYL)-7-(1-(PROP-2-ENOYL)PIPERIDIN-4-YL)-4,5,6,7-TETRAHYDROPYRAZOLO(1,5-A)PYRIMIDINE-3-CARBOXAMIDE
Systematic Name English
ZANUBRUTINIB [INN]
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 527616
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
EU-Orphan Drug EU/3/19/2167
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
FDA ORPHAN DRUG 527516
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
NCI_THESAURUS C124801
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
NCI_THESAURUS C129825
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
FDA ORPHAN DRUG 527416
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
Code System Code Type Description
CAS
1691249-45-2
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
PRIMARY
NCI_THESAURUS
C141428
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
PRIMARY
PUBCHEM
135565884
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
PRIMARY
CAS
1651179-04-2
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
NO STRUCTURE GIVEN
INN
10555
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
PRIMARY
EVMPD
SUB195236
Created by admin on Mon Oct 21 20:09:52 UTC 2019 , Edited by admin on Mon Oct 21 20:09:52 UTC 2019
PRIMARY