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Details

Stereochemistry ACHIRAL
Molecular Formula C15H10Cl2N2O
Molecular Weight 305.1591
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-CHLORO-2-(CHLOROMETHYL)-4-PHENYLQUINAZOLINE 3-OXIDE

SMILES

c1ccc(cc1)-c2c3cc(ccc3nc(CCl)n2=O)Cl

InChI

InChIKey=KFDNKXWSTFABQT-UHFFFAOYSA-N
InChI=1S/C15H10Cl2N2O/c16-9-14-18-13-7-6-11(17)8-12(13)15(19(14)20)10-4-2-1-3-5-10/h1-8H,9H2

HIDE SMILES / InChI

Molecular Formula C15H10Cl2N2O
Molecular Weight 305.1591
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Dermatitis from quinazoline oxide.
1986 Aug
Substance Class Chemical
Created
by admin
on Sat Jun 26 09:47:53 UTC 2021
Edited
by admin
on Sat Jun 26 09:47:53 UTC 2021
Record UNII
QNG87K5614
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-CHLORO-2-(CHLOROMETHYL)-4-PHENYLQUINAZOLINE 3-OXIDE
Systematic Name English
CHLORDIAZEPOXIDE HYDROCHLORIDE IMPURITY B [EP]
Common Name English
CHLORDIAZEPOXIDE HYDROCHLORIDE SPECIFIED IMPURITY B [EP]
Common Name English
2-CHLOROMETHYL-4-PHENYL-6-CHLOROQUINAZOLINE 3-OXIDE
Systematic Name English
QUINAZOLINE, 6-CHLORO-2-(CHLOROMETHYL)-4-PHENYL-, 3-OXIDE
Systematic Name English
2-(CHLOROMETHYL)-6-CHLORO-4-PHENYLQUINAZOLINE 3-OXIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
5958-24-7
Created by admin on Sat Jun 26 09:47:53 UTC 2021 , Edited by admin on Sat Jun 26 09:47:53 UTC 2021
PRIMARY
CAS
5958-24-7
Created by admin on Sat Jun 26 09:47:53 UTC 2021 , Edited by admin on Sat Jun 26 09:47:53 UTC 2021
PRIMARY
FDA UNII
QNG87K5614
Created by admin on Sat Jun 26 09:47:53 UTC 2021 , Edited by admin on Sat Jun 26 09:47:53 UTC 2021
PRIMARY
PUBCHEM
112828
Created by admin on Sat Jun 26 09:47:53 UTC 2021 , Edited by admin on Sat Jun 26 09:47:53 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP