Vitas-M small molecule compound

3,7-dimethyl-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL378446
SMILES C=CCn1c(=O)n(C)c2c(c1=O)n(C)cn2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C10H12N4O2 MW 220.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12N4O2/c1-4-5-14-9(15)7-8(11-6-12(7)2)13(3)10(14)16/h4,6H,1,5H2,2-3H3
InChIKey
BTFHIKZOEZREBX-UHFFFAOYSA-N
Synonyms
2530-99-6
1ALLYL37DIMETHYL37DIHYDROPURINE26DIONE
1ALLYLTHEOBROMINE
1HPURINE237DIHYDRO37DIMETHYL1(2PROPENYL)
1HPURINE26DIONE37DIHYDRO37DIMETHYL1(2PROPEN1YL)
1HPURINE26DIONE37DIHYDRO37DIMETHYL1(2PROPENYL)(9CI)
2530996
37dimethyl1(prop2en1yl)37dihydro1Hpurine26dione
37DIMETHYL1PROP2ENYLPURINE26DIONE
ALLYLTHEOBROMINE
CN1C=NC2=C1C(=O)N(C(=O)N2C)CC=C
InChI=1SC10H12N4O2c145149(15)78(11612(7)2)13(3)10(14)16h46H15H223H3
MFCD01682388
THEOBROMINE1ALLYL
ZINC000000349954
ZINC00349954
ZINC349954

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Available files

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