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Details

Stereochemistry ACHIRAL
Molecular Formula C15H16N6O2S
Molecular Weight 344.392
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-[[(3,4-Dimethoxyphenyl)thio]methyl]-2,4-pteridinediamine

SMILES

COC1=C(OC)C=C(SCC2=NC3=C(N)N=C(N)N=C3N=C2)C=C1

InChI

InChIKey=KVVYXYFMGZBRSZ-UHFFFAOYSA-N
InChI=1S/C15H16N6O2S/c1-22-10-4-3-9(5-11(10)23-2)24-7-8-6-18-14-12(19-8)13(16)20-15(17)21-14/h3-6H,7H2,1-2H3,(H4,16,17,18,20,21)

HIDE SMILES / InChI

Molecular Formula C15H16N6O2S
Molecular Weight 344.392
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 10:37:30 GMT 2023
Edited
by admin
on Sat Dec 16 10:37:30 GMT 2023
Record UNII
V8UFD7LB7Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-[[(3,4-Dimethoxyphenyl)thio]methyl]-2,4-pteridinediamine
Systematic Name English
2,4-Pteridinediamine, 6-[[(3,4-dimethoxyphenyl)thio]methyl]-
Systematic Name English
2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-
Systematic Name English
Code System Code Type Description
CAS
174654-77-4
Created by admin on Sat Dec 16 10:37:30 GMT 2023 , Edited by admin on Sat Dec 16 10:37:30 GMT 2023
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PUBCHEM
464985
Created by admin on Sat Dec 16 10:37:30 GMT 2023 , Edited by admin on Sat Dec 16 10:37:30 GMT 2023
PRIMARY
FDA UNII
V8UFD7LB7Z
Created by admin on Sat Dec 16 10:37:30 GMT 2023 , Edited by admin on Sat Dec 16 10:37:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID90938545
Created by admin on Sat Dec 16 10:37:30 GMT 2023 , Edited by admin on Sat Dec 16 10:37:30 GMT 2023
PRIMARY