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Details

Stereochemistry ACHIRAL
Molecular Formula C17H13BrN4O
Molecular Weight 369.215
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PD-168393

SMILES

BrC1=CC(NC2=C3C=C(NC(=O)C=C)C=CC3=NC=N2)=CC=C1

InChI

InChIKey=HTUBKQUPEREOGA-UHFFFAOYSA-N
InChI=1S/C17H13BrN4O/c1-2-16(23)21-13-6-7-15-14(9-13)17(20-10-19-15)22-12-5-3-4-11(18)8-12/h2-10H,1H2,(H,21,23)(H,19,20,22)

HIDE SMILES / InChI

Molecular Formula C17H13BrN4O
Molecular Weight 369.215
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 09:37:12 UTC 2023
Edited
by admin
on Sat Dec 16 09:37:12 UTC 2023
Record UNII
3R996Y9T0I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PD-168393
Common Name English
PD 168393 [WHO-DD]
Common Name English
2-PROPENAMIDE, N-(4-((3-BROMOPHENYL)AMINO)-6-QUINAZOLINYL)-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C2167
Created by admin on Sat Dec 16 09:37:12 UTC 2023 , Edited by admin on Sat Dec 16 09:37:12 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID80274444
Created by admin on Sat Dec 16 09:37:12 UTC 2023 , Edited by admin on Sat Dec 16 09:37:12 UTC 2023
PRIMARY
NCI_THESAURUS
C2727
Created by admin on Sat Dec 16 09:37:12 UTC 2023 , Edited by admin on Sat Dec 16 09:37:12 UTC 2023
PRIMARY
DRUG BANK
DB07662
Created by admin on Sat Dec 16 09:37:12 UTC 2023 , Edited by admin on Sat Dec 16 09:37:12 UTC 2023
PRIMARY
FDA UNII
3R996Y9T0I
Created by admin on Sat Dec 16 09:37:12 UTC 2023 , Edited by admin on Sat Dec 16 09:37:12 UTC 2023
PRIMARY
PUBCHEM
4708
Created by admin on Sat Dec 16 09:37:12 UTC 2023 , Edited by admin on Sat Dec 16 09:37:12 UTC 2023
PRIMARY
CAS
194423-15-9
Created by admin on Sat Dec 16 09:37:12 UTC 2023 , Edited by admin on Sat Dec 16 09:37:12 UTC 2023
PRIMARY
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