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

Details

Stereochemistry ACHIRAL
Molecular Formula C27H22F2N4O3
Molecular Weight 488.4854
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PARPI

SMILES

FC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(CC4=NNC(=O)C5=C4C=CC=C5)=CC=C3F

InChI

InChIKey=LTZZZXXIKHHTMO-UHFFFAOYSA-N
InChI=1S/C27H22F2N4O3/c28-19-8-6-18(7-9-19)26(35)32-11-13-33(14-12-32)27(36)22-15-17(5-10-23(22)29)16-24-20-3-1-2-4-21(20)25(34)31-30-24/h1-10,15H,11-14,16H2,(H,31,34)

HIDE SMILES / InChI

Approval Year

Name Type Language
PARPI
Common Name English
1(2H)-PHTHALAZINONE, 4-((4-FLUORO-3-((4-(4-(FLUORO)BENZOYL)-1-PIPERAZINYL)CARBONYL)PHENYL)METHYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
130443213
Created by admin on Sat Dec 16 15:02:04 GMT 2023 , Edited by admin on Sat Dec 16 15:02:04 GMT 2023
PRIMARY
FDA UNII
OWV057OPZ3
Created by admin on Sat Dec 16 15:02:04 GMT 2023 , Edited by admin on Sat Dec 16 15:02:04 GMT 2023
PRIMARY
CAS
1919043-65-4
Created by admin on Sat Dec 16 15:02:04 GMT 2023 , Edited by admin on Sat Dec 16 15:02:04 GMT 2023
PRIMARY