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Details

Stereochemistry ACHIRAL
Molecular Formula C19H22ClN5O.ClH
Molecular Weight 408.3254
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CHLORO TRAZODONE ISOMER HYDROCHLORIDE

SMILES

c1ccn2c(c1)nn(CCCN3CCN(CC3)c4ccc(cc4)Cl)c2=O.Cl

InChI

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

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.4609
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C19H22ClN5O
Molecular Weight 371.8645
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 Fri Jun 25 23:28:25 UTC 2021
Edited
by admin
on Fri Jun 25 23:28:25 UTC 2021
Record UNII
AXD9D9J5OR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-CHLORO TRAZODONE ISOMER HYDROCHLORIDE
Common Name English
TRAZODONE RELATED COMPOUND C [USP-RS]
Common Name English
TRAZODONE RELATED COMPOUND C RS [USP]
Common Name English
1,2,4-TRIAZOLO(4,3-A)PYRIDIN-3(2H)-ONE, 2-(3-(4-(4-CHLOROPHENYL)-1-PIPERAZINYL)PROPYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
TRAZODONE RELATED COMPOUND C [USP]
Common Name English
TRAZODONE RELATED COMPOUND C
USP   USP-RS  
Common Name English
2-(3-(4-(4-CHLOROPHENYL)PIPERAZIN-1-YL)PROPYL)-(1,2,4)TRIAZOLO(4,3-A)PYRIDIN-3(2H)-ONE HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
USP_CATALOG
1673533
Created by admin on Fri Jun 25 23:28:25 UTC 2021 , Edited by admin on Fri Jun 25 23:28:25 UTC 2021
PRIMARY USP-RS
FDA UNII
AXD9D9J5OR
Created by admin on Fri Jun 25 23:28:25 UTC 2021 , Edited by admin on Fri Jun 25 23:28:25 UTC 2021
PRIMARY
PUBCHEM
72942008
Created by admin on Fri Jun 25 23:28:25 UTC 2021 , Edited by admin on Fri Jun 25 23:28:25 UTC 2021
PRIMARY
CAS
1263278-77-8
Created by admin on Fri Jun 25 23:28:25 UTC 2021 , Edited by admin on Fri Jun 25 23:28:25 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP