7-PROPARGYL 1,3-DIMETHYLXANTHINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H10N4O2
Molecular Weight	218.212
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-PROPARGYL 1,3-DIMETHYLXANTHINE

Structure Search

SMILES

CN1C2=C(N(CC#C)C=N2)C(=O)N(C)C1=O

InChI

InChIKey=DKHAOCKWCMAXNV-UHFFFAOYSA-N

InChI=1S/C10H10N4O2/c1-4-5-14-6-11-8-7(14)9(15)13(3)10(16)12(8)2/h1,6H,5H2,2-3H3

HIDE SMILES / InChI

Approval Year

Name

Type

Language

7-PROPARGYL 1,3-DIMETHYLXANTHINE

Systematic Name

English

3,7-DIHYDRO-1,3-DIMETHYL-7-(2-PROPYN-1-YL)-1H-PURINE-2,6-DIONE

Systematic Name

English

1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-1,3-DIMETHYL-7-(2-PROPYNYL)-

Systematic Name

English

THEOPHYLLINE, 7-(2-PROPYNYL)-

Systematic Name

English

1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-1,3-DIMETHYL-7-(2-PROPYN-1-YL)-

Systematic Name

English

NSC-515504

Code

English

Code System Code Type Description

EPA CompTox

DTXSID70161576

Created by admin on Sat Dec 16 12:55:08 GMT 2023 , Edited by admin on Sat Dec 16 12:55:08 GMT 2023

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CAS

14114-45-5

Created by admin on Sat Dec 16 12:55:08 GMT 2023 , Edited by admin on Sat Dec 16 12:55:08 GMT 2023

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NSC

515504

Created by admin on Sat Dec 16 12:55:08 GMT 2023 , Edited by admin on Sat Dec 16 12:55:08 GMT 2023

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PUBCHEM

101422

Created by admin on Sat Dec 16 12:55:08 GMT 2023 , Edited by admin on Sat Dec 16 12:55:08 GMT 2023

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FDA UNII

NV128EH6B5

Created by admin on Sat Dec 16 12:55:08 GMT 2023 , Edited by admin on Sat Dec 16 12:55:08 GMT 2023

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SUBSTANCE RECORD


					NV128EH6B5

7-PROPARGYL 1,3-DIMETHYLXANTHINE