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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H18ClN5.C4H6O4
Molecular Weight 433.889
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sandoz 200-125

SMILES

OC(=O)CCC(O)=O.CN1CCN(CC1)C2=NC3=C(NN4C=CC=C24)C=CC(Cl)=C3

InChI

InChIKey=POCFMMUVUVHJJL-UHFFFAOYSA-N
InChI=1S/C16H18ClN5.C4H6O4/c1-20-7-9-21(10-8-20)16-15-3-2-6-22(15)19-13-5-4-12(17)11-14(13)18-16;5-3(6)1-2-4(7)8/h2-6,11,19H,7-10H2,1H3;1-2H2,(H,5,6)(H,7,8)

HIDE SMILES / InChI

Molecular Formula C16H18ClN5
Molecular Weight 315.801
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C4H6O4
Molecular Weight 118.088
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:56:49 GMT 2025
Edited
by admin
on Mon Mar 31 21:56:49 GMT 2025
Record UNII
TDN67A7883
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5H-Pyrrolo[1,2-b][1,2,5]benzotriazepine, 8-chloro-11-(4-methyl-1-piperazinyl)-, butanedioate (1:1)
Preferred Name English
Sandoz 200-125
Common Name English
Butanedioic acid, compd. with 8-chloro-11-(4-methyl-1-piperazinyl)-5H-pyrrolo[1,2-b][1,2,5]benzotriazepine (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
TDN67A7883
Created by admin on Mon Mar 31 21:56:49 GMT 2025 , Edited by admin on Mon Mar 31 21:56:49 GMT 2025
PRIMARY
CAS
102636-45-3
Created by admin on Mon Mar 31 21:56:49 GMT 2025 , Edited by admin on Mon Mar 31 21:56:49 GMT 2025
PRIMARY
EPA CompTox
DTXSID00145425
Created by admin on Mon Mar 31 21:56:49 GMT 2025 , Edited by admin on Mon Mar 31 21:56:49 GMT 2025
PRIMARY