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Details

Stereochemistry ACHIRAL
Molecular Formula C11H11Cl2N3O2
Molecular Weight 288.13
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANAGRELIDE OPEN RING METHYL ESTER

SMILES

COC(=O)CN1CC2=C(Cl)C(Cl)=CC=C2N=C1N

InChI

InChIKey=GPQHPFJCLXKFHS-UHFFFAOYSA-N
InChI=1S/C11H11Cl2N3O2/c1-18-9(17)5-16-4-6-8(15-11(16)14)3-2-7(12)10(6)13/h2-3H,4-5H2,1H3,(H2,14,15)

HIDE SMILES / InChI

Molecular Formula C11H11Cl2N3O2
Molecular Weight 288.13
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 18:17:55 GMT 2023
Edited
by admin
on Sat Dec 16 18:17:55 GMT 2023
Record UNII
H97N36S43S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANAGRELIDE OPEN RING METHYL ESTER
Common Name English
3(4H)-QUINAZOLINEACETIC ACID, 2-AMINO-5,6-DICHLORO-, METHYL ESTER
Systematic Name English
METHYL 2-AMINO-5,6-DICHLORO-3(4H)-QUINAZOLINEACETATE
Common Name English
Code System Code Type Description
CAS
752151-24-9
Created by admin on Sat Dec 16 18:17:55 GMT 2023 , Edited by admin on Sat Dec 16 18:17:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID90431304
Created by admin on Sat Dec 16 18:17:55 GMT 2023 , Edited by admin on Sat Dec 16 18:17:55 GMT 2023
PRIMARY
FDA UNII
H97N36S43S
Created by admin on Sat Dec 16 18:17:55 GMT 2023 , Edited by admin on Sat Dec 16 18:17:55 GMT 2023
PRIMARY
PUBCHEM
9818697
Created by admin on Sat Dec 16 18:17:55 GMT 2023 , Edited by admin on Sat Dec 16 18:17:55 GMT 2023
PRIMARY
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