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Details

Stereochemistry ACHIRAL
Molecular Formula C19H23ClN5O
Molecular Weight 372.872
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of Isotrazodone

SMILES

ClC1=CC(=CC=C1)N2CCN(CCC[N+]3=C4C=CC=CN4C(=O)N3)CC2

InChI

InChIKey=WGDCDCMDVKNMEF-UHFFFAOYSA-O
InChI=1S/C19H22ClN5O/c20-16-5-3-6-17(15-16)23-13-11-22(12-14-23)8-4-10-25-18-7-1-2-9-24(18)19(26)21-25/h1-3,5-7,9,15H,4,8,10-14H2/p+1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Isotrazodone
Common Name English
1,2,4-Triazolo[4,3-a]pyridinium, 1-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-3-oxo-
Preferred Name English
1-[3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl]-3-oxo-1,2,4-triazolo[4,3-a]pyridinium
Systematic Name English
Code System Code Type Description
PUBCHEM
139024792
Created by admin on Tue Apr 01 17:05:40 GMT 2025 , Edited by admin on Tue Apr 01 17:05:40 GMT 2025
PRIMARY
CAS
157072-18-9
Created by admin on Tue Apr 01 17:05:40 GMT 2025 , Edited by admin on Tue Apr 01 17:05:40 GMT 2025
PRIMARY
FDA UNII
VPR2REL3DJ
Created by admin on Tue Apr 01 17:05:40 GMT 2025 , Edited by admin on Tue Apr 01 17:05:40 GMT 2025
PRIMARY
SUBSTANCE RECORD
Structure of Isotrazodone
NIH
NCATS
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