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Details

Stereochemistry RACEMIC
Molecular Formula C19H21F2N3O3S
Molecular Weight 409.45
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PD-120755

SMILES

CCNCC1CCN(C1)C2=C(F)C3=C(C=C2F)C(=O)C(C(O)=O)=C4SCCN34

InChI

InChIKey=FWEDMKLWKZKMBM-UHFFFAOYSA-N
InChI=1S/C19H21F2N3O3S/c1-2-22-8-10-3-4-23(9-10)16-12(20)7-11-15(14(16)21)24-5-6-28-18(24)13(17(11)25)19(26)27/h7,10,22H,2-6,8-9H2,1H3,(H,26,27)

HIDE SMILES / InChI

Molecular Formula C19H21F2N3O3S
Molecular Weight 409.45
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:53:26 GMT 2025
Edited
by admin
on Mon Mar 31 22:53:26 GMT 2025
Record UNII
13O10D507I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PD-120755
Common Name English
5H-THIAZOLO(3,2-A)QUINOLINE-4-CARBOXYLIC ACID, 8-(3-((ETHYLAMINO)METHYL)-1-PYRROLIDINYL)-7,9-DIFLUORO-1,2-DIHYDRO-5-OXO-
Preferred Name English
Code System Code Type Description
EPA CompTox
DTXSID60939685
Created by admin on Mon Mar 31 22:53:26 GMT 2025 , Edited by admin on Mon Mar 31 22:53:26 GMT 2025
PRIMARY
PUBCHEM
465471
Created by admin on Mon Mar 31 22:53:26 GMT 2025 , Edited by admin on Mon Mar 31 22:53:26 GMT 2025
PRIMARY
FDA UNII
13O10D507I
Created by admin on Mon Mar 31 22:53:26 GMT 2025 , Edited by admin on Mon Mar 31 22:53:26 GMT 2025
PRIMARY
CAS
183135-68-4
Created by admin on Mon Mar 31 22:53:26 GMT 2025 , Edited by admin on Mon Mar 31 22:53:26 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY