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Details

Stereochemistry ACHIRAL
Molecular Formula C16H12ClN3O
Molecular Weight 297.739
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (5-CHLORO-2-(3-METHYL-4H-1,2,4-TRIAZOL-4-YL)PHENYL)PHENYLMETHANONE

SMILES

CC1=NN=CN1C2=C(C=C(Cl)C=C2)C(=O)C3=CC=CC=C3

InChI

InChIKey=VUIFLGOWWHHEKJ-UHFFFAOYSA-N
InChI=1S/C16H12ClN3O/c1-11-19-18-10-20(11)15-8-7-13(17)9-14(15)16(21)12-5-3-2-4-6-12/h2-10H,1H3

HIDE SMILES / InChI

Molecular Formula C16H12ClN3O
Molecular Weight 297.739
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 06:52:44 UTC 2023
Edited
by admin
on Sat Dec 16 06:52:44 UTC 2023
Record UNII
LWT0XBZ74S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(5-CHLORO-2-(3-METHYL-4H-1,2,4-TRIAZOL-4-YL)PHENYL)PHENYLMETHANONE
Systematic Name English
BENZOPHENONE, 5-CHLORO-2-(3-METHYL-4H-1,2,4-TRIAZOL-4-YL)-
Systematic Name English
ALPRAZOLAM IMPURITY C [EP IMPURITY]
Common Name English
METHANONE, (5-CHLORO-2-(3-METHYL-4H-1,2,4-TRIAZOL-4-YL)PHENYL)PHENYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
12246016
Created by admin on Sat Dec 16 06:52:45 UTC 2023 , Edited by admin on Sat Dec 16 06:52:45 UTC 2023
PRIMARY
EPA CompTox
DTXSID70190402
Created by admin on Sat Dec 16 06:52:45 UTC 2023 , Edited by admin on Sat Dec 16 06:52:45 UTC 2023
PRIMARY
CAS
36916-19-5
Created by admin on Sat Dec 16 06:52:45 UTC 2023 , Edited by admin on Sat Dec 16 06:52:45 UTC 2023
PRIMARY
FDA UNII
LWT0XBZ74S
Created by admin on Sat Dec 16 06:52:45 UTC 2023 , Edited by admin on Sat Dec 16 06:52:45 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
total: not more than the area of the principal peak in the chromatogram obtained with reference solution (b) (0.25 per cent)
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP