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Details

Stereochemistry ACHIRAL
Molecular Formula C22H27N3OS.2C4H4O4
Molecular Weight 613.679
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of ZOLANTIDINE DIMALEATE

SMILES

OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.C(CNC1=NC2=C(S1)C=CC=C2)COC3=CC=CC(CN4CCCCC4)=C3

InChI

InChIKey=IECBEVAUEBZJCF-SPIKMXEPSA-N
InChI=1S/C22H27N3OS.2C4H4O4/c1-4-13-25(14-5-1)17-18-8-6-9-19(16-18)26-15-7-12-23-22-24-20-10-2-3-11-21(20)27-22;2*5-3(6)1-2-4(7)8/h2-3,6,8-11,16H,1,4-5,7,12-15,17H2,(H,23,24);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-

HIDE SMILES / InChI

Approval Year

Name Type Language
ZOLANTIDINE DIMALEATE
Common Name English
2-BENZOTHIAZOLAMINE, N-(3-(3-(1-PIPERIDINYLMETHYL)PHENOXY)PROPYL)-, (2Z)-2-BUTENEDIOATE (1:2)
Systematic Name English
N-(3-(3-(1-PIPERIDINYLMETHYL)PHENOXY)PROPYL)-2-BENZOTHIAZOLAMINE DIMALEATE
Systematic Name English
Code System Code Type Description
PUBCHEM
11957725
Created by admin on Sat Dec 16 08:35:15 UTC 2023 , Edited by admin on Sat Dec 16 08:35:15 UTC 2023
PRIMARY
CAS
104076-39-3
Created by admin on Sat Dec 16 08:35:15 UTC 2023 , Edited by admin on Sat Dec 16 08:35:15 UTC 2023
PRIMARY
FDA UNII
AL1YII70LM
Created by admin on Sat Dec 16 08:35:15 UTC 2023 , Edited by admin on Sat Dec 16 08:35:15 UTC 2023
PRIMARY
EPA CompTox
DTXSID7045811
Created by admin on Sat Dec 16 08:35:15 UTC 2023 , Edited by admin on Sat Dec 16 08:35:15 UTC 2023
PRIMARY