U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C12H11N5S
Molecular Weight 257.314
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-BENZYLTHIOGUANINE

SMILES

NC1=NC2=NC=NC2=C(N1)SCC3=CC=CC=C3

InChI

InChIKey=JQMGATKUPCKDEG-UHFFFAOYSA-N
InChI=1S/C12H11N5S/c13-12-16-10-9(14-7-15-10)11(17-12)18-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H3,13,14,15,16,17)

HIDE SMILES / InChI

Molecular Formula C12H11N5S
Molecular Weight 257.314
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Purine analogs as potential anticytomegalovirus agents.
1969 Sep
Substance Class Chemical
Created
by admin
on Sat Dec 16 07:01:19 GMT 2023
Edited
by admin
on Sat Dec 16 07:01:19 GMT 2023
Record UNII
Z89Y54IWIJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-BENZYLTHIOGUANINE
Common Name English
1H-PURIN-2-AMINE, 6-((PHENYLMETHYL)THIO)-
Systematic Name English
PURINE, 2-AMINO-6-(BENZYLTHIO)-
Systematic Name English
BTG
Common Name English
2-AMINO-6-(BENZYLTHIO)PURINE
Systematic Name English
NSC-15747
Code English
2-AMINO-6-BENZYL-MP
Common Name English
6-((PHENYLMETHYL)THIO)-1H-PURIN-2-AMINE
Systematic Name English
BENZYLTHIOGUANINE
Systematic Name English
9H-PURIN-2-AMINE, 6-((PHENYLMETHYL)THIO)-
Systematic Name English
Code System Code Type Description
PUBCHEM
74644
Created by admin on Sat Dec 16 07:01:19 GMT 2023 , Edited by admin on Sat Dec 16 07:01:19 GMT 2023
PRIMARY
ECHA (EC/EINECS)
217-502-2
Created by admin on Sat Dec 16 07:01:19 GMT 2023 , Edited by admin on Sat Dec 16 07:01:19 GMT 2023
PRIMARY
NSC
15747
Created by admin on Sat Dec 16 07:01:19 GMT 2023 , Edited by admin on Sat Dec 16 07:01:19 GMT 2023
PRIMARY
FDA UNII
Z89Y54IWIJ
Created by admin on Sat Dec 16 07:01:19 GMT 2023 , Edited by admin on Sat Dec 16 07:01:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID40172053
Created by admin on Sat Dec 16 07:01:19 GMT 2023 , Edited by admin on Sat Dec 16 07:01:19 GMT 2023
PRIMARY
CAS
1874-58-4
Created by admin on Sat Dec 16 07:01:19 GMT 2023 , Edited by admin on Sat Dec 16 07:01:19 GMT 2023
PRIMARY