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Details

Stereochemistry ACHIRAL
Molecular Formula C15H18N4O
Molecular Weight 270.3296
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6-DIAMINO-5-(4-PHENYLBUTYL)-4-PYRIMIDINECARBOXALDEHYDE

SMILES

NC1=NC(N)=C(CCCCC2=CC=CC=C2)C(C=O)=N1

InChI

InChIKey=ZYSUCKDURHLPJA-UHFFFAOYSA-N
InChI=1S/C15H18N4O/c16-14-12(13(10-20)18-15(17)19-14)9-5-4-8-11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H4,16,17,18,19)

HIDE SMILES / InChI

Molecular Formula C15H18N4O
Molecular Weight 270.3296
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 Tue Apr 01 19:56:28 GMT 2025
Edited
by admin
on Tue Apr 01 19:56:28 GMT 2025
Record UNII
IQF5NPS3ZY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,6-DIAMINO-5-(4-PHENYLBUTYL)-4-PYRIMIDINECARBOXALDEHYDE
Systematic Name English
NSC-212183
Preferred Name English
4-PYRIMIDINECARBOXALDEHYDE, 2,6-DIAMINO-5-(4-PHENYLBUTYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
IQF5NPS3ZY
Created by admin on Tue Apr 01 19:56:28 GMT 2025 , Edited by admin on Tue Apr 01 19:56:28 GMT 2025
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PUBCHEM
309754
Created by admin on Tue Apr 01 19:56:28 GMT 2025 , Edited by admin on Tue Apr 01 19:56:28 GMT 2025
PRIMARY
CAS
17005-34-4
Created by admin on Tue Apr 01 19:56:28 GMT 2025 , Edited by admin on Tue Apr 01 19:56:28 GMT 2025
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NSC
212183
Created by admin on Tue Apr 01 19:56:28 GMT 2025 , Edited by admin on Tue Apr 01 19:56:28 GMT 2025
PRIMARY
EPA CompTox
DTXSID60168791
Created by admin on Tue Apr 01 19:56:28 GMT 2025 , Edited by admin on Tue Apr 01 19:56:28 GMT 2025
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