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Details

Stereochemistry ACHIRAL
Molecular Formula C19H20ClN3O4S
Molecular Weight 421.898
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of W-18

SMILES

[O-][N+](=O)C1=CC=C(CCN2CCCC\C2=N/S(=O)(=O)C3=CC=C(Cl)C=C3)C=C1

InChI

InChIKey=BKRSVROQVRTSND-XUTLUUPISA-N
InChI=1S/C19H20ClN3O4S/c20-16-6-10-18(11-7-16)28(26,27)21-19-3-1-2-13-22(19)14-12-15-4-8-17(9-5-15)23(24)25/h4-11H,1-3,12-14H2/b21-19+

HIDE SMILES / InChI

Molecular Formula C19H20ClN3O4S
Molecular Weight 421.898
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 16:49:25 UTC 2023
Edited
by admin
on Thu Jul 06 16:49:25 UTC 2023
Record UNII
04WOYJF7QH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
W-18
Common Name English
4-CHLORO-N-(1-(2-(4-NITROPHENYL)ETHYL)-PIPERIDIN-2-YLIDENE)BENZENESULFONAMIDE
Systematic Name English
BENZENESULFONAMIDE, 4-CHLORO-N-(1-(2-(4-NITROPHENYL)ETHYL)-2-PIPERIDINYLIDENE)-
Systematic Name English
Classification Tree Code System Code
WIKIPEDIA Designer-drugs-W-18
Created by admin on Thu Jul 06 16:49:25 UTC 2023 , Edited by admin on Thu Jul 06 16:49:25 UTC 2023
Code System Code Type Description
WIKIPEDIA
W-18
Created by admin on Thu Jul 06 16:49:25 UTC 2023 , Edited by admin on Thu Jul 06 16:49:25 UTC 2023
PRIMARY
EPA CompTox
DTXSID90726944
Created by admin on Thu Jul 06 16:49:25 UTC 2023 , Edited by admin on Thu Jul 06 16:49:25 UTC 2023
PRIMARY
FDA UNII
04WOYJF7QH
Created by admin on Thu Jul 06 16:49:25 UTC 2023 , Edited by admin on Thu Jul 06 16:49:25 UTC 2023
PRIMARY
PUBCHEM
13373555
Created by admin on Thu Jul 06 16:49:25 UTC 2023 , Edited by admin on Thu Jul 06 16:49:25 UTC 2023
PRIMARY
CAS
93101-02-1
Created by admin on Thu Jul 06 16:49:25 UTC 2023 , Edited by admin on Thu Jul 06 16:49:25 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY