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Details

Stereochemistry ACHIRAL
Molecular Formula C19H22BrN5O
Molecular Weight 416.3151
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-DECHLORO-3-BROMO TRAZODONE

SMILES

c1ccn2c(c1)nn(CCCN3CCN(CC3)c4cccc(c4)Br)c2=O

InChI

InChIKey=HNSTYKJQMWGCRU-UHFFFAOYSA-N
InChI=1S/C19H22BrN5O/c20-16-5-3-6-17(15-16)23-13-11-22(12-14-23)8-4-10-25-19(26)24-9-2-1-7-18(24)21-25/h1-3,5-7,9,15H,4,8,10-14H2

HIDE SMILES / InChI

Molecular Formula C19H22BrN5O
Molecular Weight 416.3151
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 Sat Jun 26 11:47:43 UTC 2021
Edited
by admin
on Sat Jun 26 11:47:43 UTC 2021
Record UNII
5862R5WA2P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-DECHLORO-3-BROMO TRAZODONE
Common Name English
TRAZODONE RELATED COMPOUND D FREE BASE
Common Name English
TRAZODONE HYDROCHLORIDE IMPURITY D [BP]
Common Name English
2-3-(4-(3-BROMOPHENYL)PIPERAZIN-1-YL)PROPYL-1,2,4-TRIAZOLO(4,3-A)PYRIDIN-3(2H)-ONE
Systematic Name English
1,2,4-TRIAZOLO(4,3-A)PYRIDIN-3(2H)-ONE, 2-(3-(4-(3-BROMOPHENYL)-1-PIPERAZINYL)PROPYL)-
Systematic Name English
3-DESCHLORO-3-BROMO TRAZODONE
Common Name English
Code System Code Type Description
CAS
1263358-13-9
Created by admin on Sat Jun 26 11:47:43 UTC 2021 , Edited by admin on Sat Jun 26 11:47:43 UTC 2021
PRIMARY
FDA UNII
5862R5WA2P
Created by admin on Sat Jun 26 11:47:43 UTC 2021 , Edited by admin on Sat Jun 26 11:47:43 UTC 2021
PRIMARY
PUBCHEM
71315238
Created by admin on Sat Jun 26 11:47:43 UTC 2021 , Edited by admin on Sat Jun 26 11:47:43 UTC 2021
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
PARENT -> IMPURITY
UNSPECIFIED