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Details

Stereochemistry RACEMIC
Molecular Formula C15H14ClN3O
Molecular Weight 287.744
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-AMINO-6-CHLORO-2-METHYL-4-PHENYL-3,4-DIHYDROQUINAZOLIN-4-OL

SMILES

CC1=NC2=C(C=C(Cl)C=C2)C(O)(N1N)C3=CC=CC=C3

InChI

InChIKey=IEQYCNKKNGEMAN-UHFFFAOYSA-N
InChI=1S/C15H14ClN3O/c1-10-18-14-8-7-12(16)9-13(14)15(20,19(10)17)11-5-3-2-4-6-11/h2-9,20H,17H2,1H3

HIDE SMILES / InChI

Molecular Formula C15H14ClN3O
Molecular Weight 287.744
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

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
2XW58UPC7A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-AMINO-6-CHLORO-2-METHYL-4-PHENYL-3,4-DIHYDROQUINAZOLIN-4-OL
Systematic Name English
(4RS)-3-AMINO-6-CHLORO-2-METHYL-4-PHENYL-3,4-DIHYDROQUINAZOLIN-4-OL
Systematic Name English
ALPRAZOLAM IMPURITY A [EP IMPURITY]
Common Name English
4-QUINAZOLINOL, 3-AMINO-6-CHLORO-3,4-DIHYDRO-2-METHYL-4-PHENYL-
Systematic Name English
(±)-3-AMINO-6-CHLORO-2-METHYL-4-PHENYL-3,4-DIHYDROQUINAZOLIN-4-OL
Systematic Name English
3-AMINO-6-CHLORO-3,4-DIHYDRO-4-HYDROXY-2-METHYL-4-PHENYLQUINAZOLINE
Systematic Name English
Code System Code Type Description
PUBCHEM
20360443
Created by admin on Sat Dec 16 06:52:44 UTC 2023 , Edited by admin on Sat Dec 16 06:52:44 UTC 2023
PRIMARY
FDA UNII
2XW58UPC7A
Created by admin on Sat Dec 16 06:52:44 UTC 2023 , Edited by admin on Sat Dec 16 06:52:44 UTC 2023
PRIMARY
CAS
27537-87-7
Created by admin on Sat Dec 16 06:52:44 UTC 2023 , Edited by admin on Sat Dec 16 06:52:44 UTC 2023
PRIMARY
EPA CompTox
DTXSID001183065
Created by admin on Sat Dec 16 06:52:44 UTC 2023 , Edited by admin on Sat Dec 16 06:52:44 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