Vitas-M small molecule compound
1,3-dimethyl-7-(3-methylbenzyl)-8-(prop-2-en-1-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK840476
SMILES C=CCSc1nc2c(n1Cc1cccc(c1)C)c(=O)n(c(=O)n2C)C
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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 C18H20N4O2S MW 356.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O2S/c1-5-9-25-17-19-15-14(16(23)21(4)18(24)20(15)3)22(17)11-13-8-6-7-12(2)10-13/h5-8,10H,1,9,11H2,2-4H3InChIKey
JUOHWHSMMORMEA-UHFFFAOYSA-NSynonyms
384375-60-413DIMETHYL7((3METHYLPHENYL)METHYL)8PROP2ENYLSULFANYLPURINE26DIONE
13DIMETHYL7((3METHYLPHENYL)METHYL)8PROP2ENYLTHIO137TRIHYDROPURINE26DIONE
13dimethyl7(3methylbenzyl)8(prop2en1ylsulfanyl)37dihydro1Hpurine26dione
384375604
8(ALLYLTHIO)13DIMETHYL7(3METHYLBENZYL)1HPURINE26(3H7H)DIONE
8ALLYLSULFANYL13DIMETHYL7(3METHYLBENZYL)37DIHYDROPURINE26DIONE
CC1=CC(=CC=C1)CN2C3=C(N=C2SCC=C)N(C(=O)N(C3=O)C)C
InChI=1SC18H20N4O2Sc1592517191514(16(23)21(4)18(24)20(15)3)22(17)111386712(2)1013h5810H1911H224H3
MFCD03285017
ZINC000012377498
ZINC12377498
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