Vitas-M small molecule compound

6-hydroxy-3-methyl-7-(prop-2-en-1-yl)-8-(prop-2-en-1-ylsulfanyl)-3,7-dihydro-2H-purin-2-one

Catalog ID
STK594481
SMILES C=CCn1c(SCC=C)nc2c1c(O)nc(=O)n2C

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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 C12H14N4O2S MW 278.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4O2S/c1-4-6-16-8-9(13-12(16)19-7-5-2)15(3)11(18)14-10(8)17/h4-5H,1-2,6-7H2,3H3,(H,14,17,18)
InChIKey
CZZVBODZMQRYAY-UHFFFAOYSA-N
Synonyms
330990-66-4
330990664
3METHYL7PROP2ENYL8PROP2ENYLSULFANYLPURINE26DIONE
3METHYL7PROP2ENYL8PROP2ENYLTHIO137TRIHYDROPURINE26DIONE
6hydroxy3methyl7(prop2en1yl)8(prop2en1ylsulfanyl)37dihydro2Hpurin2one
7ALLYL8(ALLYLSULFANYL)3METHYL37DIHYDRO1HPURINE26DIONE
7ALLYL8ALLYLSULFANYL3METHYL37DIHYDROPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC=C)CC=C
InChI=1SC12H14N4O2Sc1461689(1312(16)19752)15(3)11(18)1410(8)17h45H1267H23H3(H141718)
MFCD07204313
ZINC000012373954
ZINC12373954

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Available files

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