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Details

Stereochemistry ACHIRAL
Molecular Formula C17H13Cl2N3O
Molecular Weight 346.211
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

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

SMILES

CC1=NN=C(CCl)N1C2=CC=C(Cl)C=C2C(=O)C3=CC=CC=C3

InChI

InChIKey=CPBUCUDVFXOMHN-UHFFFAOYSA-N
InChI=1S/C17H13Cl2N3O/c1-11-20-21-16(10-18)22(11)15-8-7-13(19)9-14(15)17(23)12-5-3-2-4-6-12/h2-9H,10H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
ALPRAZOLAM IMPURITY F [EP IMPURITY]
Preferred Name English
(5-CHLORO-2-(3-(CHLOROMETHYL)-5-METHYL-4H-1,2,4-TRIAZOL-4-YL)PHENYL)(PHENYL)METHANONE
Systematic Name English
(5-CHLORO-2-(3-(CHLOROMETHYL)-5-METHYL-4H-1,2,4-TRIAZOL-4-YL)PHENYL)PHENYLMETHANONE
Systematic Name English
METHANONE, (5-CHLORO-2-(3-(CHLOROMETHYL)-5-METHYL-4H-1,2,4-TRIAZOL-4-YL)PHENYL)PHENYL-
Systematic Name English
Code System Code Type Description
CAS
37945-07-6
Created by admin on Mon Mar 31 21:40:52 GMT 2025 , Edited by admin on Mon Mar 31 21:40:52 GMT 2025
PRIMARY
PUBCHEM
21488575
Created by admin on Mon Mar 31 21:40:52 GMT 2025 , Edited by admin on Mon Mar 31 21:40:52 GMT 2025
PRIMARY
FDA UNII
87BL93EY98
Created by admin on Mon Mar 31 21:40:52 GMT 2025 , Edited by admin on Mon Mar 31 21:40:52 GMT 2025
PRIMARY
EPA CompTox
DTXSID40191385
Created by admin on Mon Mar 31 21:40:52 GMT 2025 , Edited by admin on Mon Mar 31 21:40:52 GMT 2025
PRIMARY
NIH
NCATS
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