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Details

Stereochemistry ACHIRAL
Molecular Formula C15H10ClFN4O3.ClH
Molecular Weight 385.177
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(3-Chloro-4-fluorophenyl)-7-methoxy-6-nitroquinazolin-4-amine hydrochloride

SMILES

Cl.COC1=CC2=NC=NC(NC3=CC=C(F)C(Cl)=C3)=C2C=C1[N+]([O-])=O

InChI

InChIKey=VDBBUPIYIMVWSU-UHFFFAOYSA-N
InChI=1S/C15H10ClFN4O3.ClH/c1-24-14-6-12-9(5-13(14)21(22)23)15(19-7-18-12)20-8-2-3-11(17)10(16)4-8;/h2-7H,1H3,(H,18,19,20);1H

HIDE SMILES / InChI

Molecular Formula C15H10ClFN4O3
Molecular Weight 348.716
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
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 Wed Apr 02 19:49:24 GMT 2025
Edited
by admin
on Wed Apr 02 19:49:24 GMT 2025
Record UNII
L3MR7XDE73
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(3-Chloro-4-fluorophenyl)-7-methoxy-6-nitroquinazolin-4-amine hydrochloride
Systematic Name English
4-Quinazolinamine, N-(3-chloro-4-fluorophenyl)-7-methoxy-6-nitro-, hydrochloride (1:1)
Preferred Name English
Code System Code Type Description
FDA UNII
L3MR7XDE73
Created by admin on Wed Apr 02 19:49:24 GMT 2025 , Edited by admin on Wed Apr 02 19:49:24 GMT 2025
PRIMARY
CAS
1012057-48-5
Created by admin on Wed Apr 02 19:49:24 GMT 2025 , Edited by admin on Wed Apr 02 19:49:24 GMT 2025
PRIMARY
PUBCHEM
66755449
Created by admin on Wed Apr 02 19:49:24 GMT 2025 , Edited by admin on Wed Apr 02 19:49:24 GMT 2025
PRIMARY
Related Record Type Details
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