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Details

Stereochemistry ACHIRAL
Molecular Formula C18H17NOS.C4H4O4
Molecular Weight 411.471
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NORKETOTIFEN MONOFUMARATE

SMILES

OC(=O)\C=C\C(O)=O.O=C1CC2=C(C=CC=C2)C(C3=C1SC=C3)=C4CCNCC4

InChI

InChIKey=PDPPFVXCBONTQQ-WLHGVMLRSA-N
InChI=1S/C18H17NOS.C4H4O4/c20-16-11-13-3-1-2-4-14(13)17(12-5-8-19-9-6-12)15-7-10-21-18(15)16;5-3(6)1-2-4(7)8/h1-4,7,10,19H,5-6,8-9,11H2;1-2H,(H,5,6)(H,7,8)/b;2-1+

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
NORKETOTIFEN MONOFUMARATE
Common Name English
N-DESMETHYLKETOTIFEN HYDROGEN FUMARATE
Preferred Name English
4,9-DIHYDRO-4-(4-PIPERIDINYLIDENE)-10H-BENZO(4,5)CYCLOHEPTA(1,2-B)THIOPHEN-10-ONE HYDROGEN FUMARATE
Systematic Name English
10H-BENZO(4,5)CYCLOHEPTA(1,2-B)THIOPHEN-10-ONE, 4,9-DIHYDRO-4-(4-PIPERIDINYLIDENE)-, (2E)-2-BUTENEDIOATE (1:1)
Systematic Name English
Code System Code Type Description
CAS
930765-16-5
Created by admin on Wed Apr 02 04:08:13 GMT 2025 , Edited by admin on Wed Apr 02 04:08:13 GMT 2025
PRIMARY
PUBCHEM
45489140
Created by admin on Wed Apr 02 04:08:13 GMT 2025 , Edited by admin on Wed Apr 02 04:08:13 GMT 2025
PRIMARY
FDA UNII
A2VJW8MXW9
Created by admin on Wed Apr 02 04:08:13 GMT 2025 , Edited by admin on Wed Apr 02 04:08:13 GMT 2025
PRIMARY
ACTIVE MOIETY
Structure of NORKETOTIFEN
NIH
NCATS
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