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Details

Stereochemistry ACHIRAL
Molecular Formula C19H22ClN5O
Molecular Weight 371.864
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CHLORO TRAZODONE ISOMER

SMILES

ClC1=CC=C(C=C1)N2CCN(CCCN3N=C4C=CC=CN4C3=O)CC2

InChI

InChIKey=ZUZALSYWCGGMET-UHFFFAOYSA-N
InChI=1S/C19H22ClN5O/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

HIDE SMILES / InChI

Molecular Formula C19H22ClN5O
Molecular Weight 371.864
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 Dec 16 08:26:34 GMT 2023
Edited
by admin
on Sat Dec 16 08:26:34 GMT 2023
Record UNII
M849PY6808
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-CHLORO TRAZODONE ISOMER
Common Name English
TRAZODONE RELATED COMPOUND C FREE BASE
Common Name English
2-3-(4-(4-CHLOROPHENYL)PIPERAZIN-1-YL)PROPYL-1,2,4-TRIAZOLO(4,3-A)PYRIDIN-3(2H)-ONE
Systematic Name English
TRAZODONE HYDROCHLORIDE IMPURITY C [BP]
Common Name English
1,2,4-TRIAZOLO(4,3-A)PYRIDIN-3(2H)-ONE, 2-(3-(4-(4-CHLOROPHENYL)-1-PIPERAZINYL)PROPYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
71314821
Created by admin on Sat Dec 16 08:26:35 GMT 2023 , Edited by admin on Sat Dec 16 08:26:35 GMT 2023
PRIMARY
CAS
157072-19-0
Created by admin on Sat Dec 16 08:26:35 GMT 2023 , Edited by admin on Sat Dec 16 08:26:35 GMT 2023
PRIMARY
FDA UNII
M849PY6808
Created by admin on Sat Dec 16 08:26:35 GMT 2023 , Edited by admin on Sat Dec 16 08:26:35 GMT 2023
PRIMARY
EPA CompTox
DTXSID30166209
Created by admin on Sat Dec 16 08:26:35 GMT 2023 , Edited by admin on Sat Dec 16 08:26:35 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
PARENT -> IMPURITY
UNSPECIFIED