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Details

Stereochemistry ACHIRAL
Molecular Formula C13H13FN2O2S.2ClH.H2O
Molecular Weight 371.255
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Amsulostat dihydrochloride monohydrate

SMILES

O.Cl.Cl.NC\C=C(/F)CS(=O)(=O)C1=C2N=CC=CC2=CC=C1

InChI

InChIKey=QYKDBLBIYAHJJG-QGUCZYQJSA-N
InChI=1S/C13H13FN2O2S.2ClH.H2O/c14-11(6-7-15)9-19(17,18)12-5-1-3-10-4-2-8-16-13(10)12;;;/h1-6,8H,7,9,15H2;2*1H;1H2/b11-6-;;;

HIDE SMILES / InChI

Approval Year

Name Type Language
LOX-IN-3 dihydrochloride monohydrate
Preferred Name English
Amsulostat dihydrochloride monohydrate
Common Name English
2-BUTEN-1-AMINE, 3-FLUORO-4-(8-QUINOLINYLSULFONYL)-, HYDROCHLORIDE, HYDRATE (1:2:1), (2Z)-
Systematic Name English
Code System Code Type Description
FDA UNII
97D343VVF8
Created by admin on Wed Apr 02 08:13:28 GMT 2025 , Edited by admin on Wed Apr 02 08:13:28 GMT 2025
PRIMARY
CAS
2414974-55-1
Created by admin on Wed Apr 02 08:13:28 GMT 2025 , Edited by admin on Wed Apr 02 08:13:28 GMT 2025
PRIMARY
PUBCHEM
153398870
Created by admin on Wed Apr 02 08:13:28 GMT 2025 , Edited by admin on Wed Apr 02 08:13:28 GMT 2025
PRIMARY