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Details

Stereochemistry ACHIRAL
Molecular Formula C11H16N4OS2
Molecular Weight 284.401
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-BUTYLTHIO-6-THIOTHEOPHYLLINE

SMILES

CCCCSC1=NC2=C(N1)N(C)C(=O)N(C)C2=S

InChI

InChIKey=JTKHAEGWWHAFTM-UHFFFAOYSA-N
InChI=1S/C11H16N4OS2/c1-4-5-6-18-10-12-7-8(13-10)14(2)11(16)15(3)9(7)17/h4-6H2,1-3H3,(H,12,13)

HIDE SMILES / InChI

Approval Year

Name Type Language
8-BUTYLTHIO-6-THIOTHEOPHYLLINE
Systematic Name English
THEOPHYLLINE, 8-BUTYLTHIO-6-THIO-
Systematic Name English
NSC-95883
Code English
2H-PURIN-2-ONE, 8-(BUTYLTHIO)-1,3,6,7-TETRAHYDRO-1,3-DIMETHYL-6-THIOXO-
Systematic Name English
THEOPHYLLINE, 8-(BUTYLTHIO)-6-THIO-
Systematic Name English
8-(BUTYLTHIO)-1,3,6,9-TETRAHYDRO-1,3-DIMETHYL-6-THIOXO-2H-PURIN-2-ONE
Systematic Name English
2H-PURIN-2-ONE, 8-(BUTYLTHIO)-1,3,6,9-TETRAHYDRO-1,3-DIMETHYL-6-THIOXO-
Systematic Name English
Code System Code Type Description
PUBCHEM
3034531
Created by admin on Sat Dec 16 12:52:47 GMT 2023 , Edited by admin on Sat Dec 16 12:52:47 GMT 2023
PRIMARY
NSC
95883
Created by admin on Sat Dec 16 12:52:47 GMT 2023 , Edited by admin on Sat Dec 16 12:52:47 GMT 2023
PRIMARY
CAS
6493-29-4
Created by admin on Sat Dec 16 12:52:47 GMT 2023 , Edited by admin on Sat Dec 16 12:52:47 GMT 2023
PRIMARY
FDA UNII
4189VF1VH9
Created by admin on Sat Dec 16 12:52:47 GMT 2023 , Edited by admin on Sat Dec 16 12:52:47 GMT 2023
PRIMARY
EPA CompTox
DTXSID20215235
Created by admin on Sat Dec 16 12:52:47 GMT 2023 , Edited by admin on Sat Dec 16 12:52:47 GMT 2023
PRIMARY