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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H10F4N2O2
Molecular Weight 314.235
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4S)-4-(2-CYCLOPROPYLETHYNYL)-5-FLUORO-3,4-DIHYDRO-6-HYDROXY-4-(TRIFLUOROMETHYL)-2(1H)-QUINAZOLINONE

SMILES

OC1=CC=C2NC(=O)N[C@@](C#CC3CC3)(C2=C1F)C(F)(F)F

InChI

InChIKey=VFPCFVHIAAPSCF-ZDUSSCGKSA-N
InChI=1S/C14H10F4N2O2/c15-11-9(21)4-3-8-10(11)13(14(16,17)18,20-12(22)19-8)6-5-7-1-2-7/h3-4,7,21H,1-2H2,(H2,19,20,22)/t13-/m0/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
(4S)-4-(2-CYCLOPROPYLETHYNYL)-5-FLUORO-3,4-DIHYDRO-6-HYDROXY-4-(TRIFLUOROMETHYL)-2(1H)-QUINAZOLINONE
Systematic Name English
2(1H)-QUINAZOLINONE, 4-(2-CYCLOPROPYLETHYNYL)-5-FLUORO-3,4-DIHYDRO-6-HYDROXY-4-(TRIFLUOROMETHYL)-, (4S)-
Systematic Name English
DPC-963 METABOLITE M7
Common Name English
Code System Code Type Description
FDA UNII
RZV16A9OON
Created by admin on Sat Dec 16 16:52:39 GMT 2023 , Edited by admin on Sat Dec 16 16:52:39 GMT 2023
PRIMARY
PUBCHEM
154824279
Created by admin on Sat Dec 16 16:52:39 GMT 2023 , Edited by admin on Sat Dec 16 16:52:39 GMT 2023
PRIMARY
CAS
410090-45-8
Created by admin on Sat Dec 16 16:52:39 GMT 2023 , Edited by admin on Sat Dec 16 16:52:39 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of DPC-963
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