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

Details

Stereochemistry ACHIRAL
Molecular Formula C24H27F3N8O3.C4H4O4
Molecular Weight 648.5903
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ONVANSERTIB FUMARATE

SMILES

OC(=O)\C=C\C(O)=O.CN1CCN(CC1)C2=CC=C(OC(F)(F)F)C(NC3=NC4=C(CCC5=C4N(CCO)N=C5C(N)=O)C=N3)=C2

InChI

InChIKey=LUEMEFHVOJNLJG-WLHGVMLRSA-N
InChI=1S/C24H27F3N8O3.C4H4O4/c1-33-6-8-34(9-7-33)15-3-5-18(38-24(25,26)27)17(12-15)30-23-29-13-14-2-4-16-20(22(28)37)32-35(10-11-36)21(16)19(14)31-23;5-3(6)1-2-4(7)8/h3,5,12-13,36H,2,4,6-11H2,1H3,(H2,28,37)(H,29,30,31);1-2H,(H,5,6)(H,7,8)/b;2-1+

HIDE SMILES / InChI

Approval Year

Name Type Language
ONVANSERTIB FUMARATE
USAN  
Official Name English
1H-PYRAZOLO(4,3-H)QUINAZOLINE-3-CARBOXAMIDE, 4,5-DIHYDRO-1-(2-HYDROXYETHYL)-8-((5-(4-METHYL-1-PIPERAZINYL)-2-(TRIFLUOROMETHOXY)PHENYL)AMINO)-, (2E)-2-BUTENEDIOATE (1:1)
Systematic Name English
NMS-P937 FUMARATE
Common Name English
ONVANSERTIB FUMARATE [USAN]
Common Name English
NMS-P937 FUMARATE SALT
Common Name English
PCM-075 FUMARATE
Common Name English
PMS-075H
Code English
Classification Tree Code System Code
EU-Orphan Drug EU/3/18/2057
Created by admin on Fri Dec 15 16:52:35 GMT 2023 , Edited by admin on Fri Dec 15 16:52:35 GMT 2023
Code System Code Type Description
USAN
FG-161
Created by admin on Fri Dec 15 16:52:35 GMT 2023 , Edited by admin on Fri Dec 15 16:52:35 GMT 2023
PRIMARY
NCI_THESAURUS
C170257
Created by admin on Fri Dec 15 16:52:35 GMT 2023 , Edited by admin on Fri Dec 15 16:52:35 GMT 2023
PRIMARY
PUBCHEM
49855323
Created by admin on Fri Dec 15 16:52:35 GMT 2023 , Edited by admin on Fri Dec 15 16:52:35 GMT 2023
PRIMARY
CAS
1263293-37-3
Created by admin on Fri Dec 15 16:52:35 GMT 2023 , Edited by admin on Fri Dec 15 16:52:35 GMT 2023
PRIMARY
FDA UNII
HMP6CI6R6V
Created by admin on Fri Dec 15 16:52:35 GMT 2023 , Edited by admin on Fri Dec 15 16:52:35 GMT 2023
PRIMARY
SMS_ID
100000184179
Created by admin on Fri Dec 15 16:52:35 GMT 2023 , Edited by admin on Fri Dec 15 16:52:35 GMT 2023
PRIMARY