Vitas-M small molecule compound
8-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK838278
SMILES C=CCn1c(SC/C=C(\Cl)/C)nc2c1c(=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 C14H17ClN4O2S MW 340.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17ClN4O2S/c1-5-7-19-10-11(16-13(19)22-8-6-9(2)15)17(3)14(21)18(4)12(10)20/h5-6H,1,7-8H2,2-4H3/b9-6-InChIKey
ZUJBCLRDXXFKQG-TWGQIWQCSA-NSynonyms
(Z)7allyl8((3chlorobut2en1yl)thio)13dimethyl1Hpurine26(3H7H)dione
8(((2Z)3chlorobut2en1yl)sulfanyl)13dimethyl7(prop2en1yl)37dihydro1Hpurine26dione
8((Z)3CHLOROBUT2ENYL)SULFANYL13DIMETHYL7PROP2ENYLPURINE26DIONE
C=CCn1c(SCC=C(Cl)C)nc2c1c(=O)n(c(=O)n2C)C
CC(=CCSC1=NC2=C(N1CC=C)C(=O)N(C(=O)N2C)C)Cl
InChI=1SC14H17ClN4O2Sc157191011(1613(19)22869(2)15)17(3)14(21)18(4)12(10)20h56H178H224H3b96
MFCD02983743
ZINC000000287474
ZINC00287474
ZINC287474
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