8-BUTYLTHIO-6-THIOTHEOPHYLLINE

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National Institutes of Health Divider Arrow

NCATS

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

Structure Search

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

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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

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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

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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

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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

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SUBSTANCE RECORD


					4189VF1VH9

8-BUTYLTHIO-6-THIOTHEOPHYLLINE