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

Details

Stereochemistry ACHIRAL
Molecular Formula C18H12FN3O3S
Molecular Weight 369.37
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-((5-FLUORO-2-BENZOTHIAZOLYL)METHYL)-3,4-DIHYDRO-4-OXO-1-PHTHALAZINEACETIC ACID

SMILES

OC(=O)CC1=NN(CC2=NC3=C(S2)C=CC(F)=C3)C(=O)C4=C1C=CC=C4

InChI

InChIKey=QUBABKJOUGUHAK-UHFFFAOYSA-N
InChI=1S/C18H12FN3O3S/c19-10-5-6-15-14(7-10)20-16(26-15)9-22-18(25)12-4-2-1-3-11(12)13(21-22)8-17(23)24/h1-7H,8-9H2,(H,23,24)

HIDE SMILES / InChI

Approval Year

Name Type Language
3-((5-FLUORO-2-BENZOTHIAZOLYL)METHYL)-3,4-DIHYDRO-4-OXO-1-PHTHALAZINEACETIC ACID
Systematic Name English
1-PHTHALAZINEACETIC ACID, 3-((5-FLUORO-2-BENZOTHIAZOLYL)METHYL)-3,4-DIHYDRO-4-OXO-
Preferred Name English
Code System Code Type Description
PUBCHEM
14810720
Created by admin on Mon Mar 31 18:04:35 GMT 2025 , Edited by admin on Mon Mar 31 18:04:35 GMT 2025
PRIMARY
FDA UNII
S5I7HG1V0F
Created by admin on Mon Mar 31 18:04:35 GMT 2025 , Edited by admin on Mon Mar 31 18:04:35 GMT 2025
PRIMARY
CAS
110721-88-5
Created by admin on Mon Mar 31 18:04:35 GMT 2025 , Edited by admin on Mon Mar 31 18:04:35 GMT 2025
PRIMARY