8-(DECYLTHIO)-2-THIOTHEOPHYLLINE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H28N4OS2
Molecular Weight	368.56
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 8-(DECYLTHIO)-2-THIOTHEOPHYLLINE

Structure Search

SMILES

CCCCCCCCCCSC1=NC2=C(N1)C(=O)N(C)C(=S)N2C

InChI

InChIKey=QHQKXMOBJVNMNT-UHFFFAOYSA-N

InChI=1S/C17H28N4OS2/c1-4-5-6-7-8-9-10-11-12-24-16-18-13-14(19-16)20(2)17(23)21(3)15(13)22/h4-12H2,1-3H3,(H,18,19)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

8-(DECYLTHIO)-2-THIOTHEOPHYLLINE

Systematic Name

English

NSC-95923

Code

English

8-(DECYLTHIO)-1,2,3,9-TETRAHYDRO-1,3-DIMETHYL-2-THIOXO-6H-PURIN-6-ONE

Systematic Name

English

THEOPHYLLINE, 8-DECYLTHIO-2-THIO-

Systematic Name

English

6H-PURIN-6-ONE, 8-(DECYLTHIO)-1,2,3,9-TETRAHYDRO-1,3-DIMETHYL-2-THIOXO-

Systematic Name

English

Code System Code Type Description

CAS

6466-10-0

Created by admin on Sat Dec 16 13:08:11 GMT 2023 , Edited by admin on Sat Dec 16 13:08:11 GMT 2023

PRIMARY

PUBCHEM

201648

Created by admin on Sat Dec 16 13:08:11 GMT 2023 , Edited by admin on Sat Dec 16 13:08:11 GMT 2023

PRIMARY

NSC

95923

Created by admin on Sat Dec 16 13:08:11 GMT 2023 , Edited by admin on Sat Dec 16 13:08:11 GMT 2023

PRIMARY

EPA CompTox

DTXSID60214924

Created by admin on Sat Dec 16 13:08:11 GMT 2023 , Edited by admin on Sat Dec 16 13:08:11 GMT 2023

PRIMARY

FDA UNII

UV0NXM41YY

Created by admin on Sat Dec 16 13:08:11 GMT 2023 , Edited by admin on Sat Dec 16 13:08:11 GMT 2023

PRIMARY

SUBSTANCE RECORD


					UV0NXM41YY

8-(DECYLTHIO)-2-THIOTHEOPHYLLINE