Vitas-M small molecule compound
7-[(2E)-but-2-en-1-yl]-3-methyl-8-[(2-methylprop-2-en-1-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK833949
SMILES C/C=C/Cn1c(SCC(=C)C)nc2c1c(=O)[nH]c(=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 C14H18N4O2S MW 306.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N4O2S/c1-5-6-7-18-10-11(15-14(18)21-8-9(2)3)17(4)13(20)16-12(10)19/h5-6H,2,7-8H2,1,3-4H3,(H,16,19,20)/b6-5+InChIKey
WUOYPKDRZKCARM-AATRIKPKSA-NSynonyms
333768-86-8(E)7(but2en1yl)3methyl8((2methylallyl)thio)1Hpurine26(3H7H)dione
333768868
7((2E)but2en1yl)3methyl8((2methylprop2en1yl)sulfanyl)37dihydro1Hpurine26dione
7((2E)BUT2ENYL)3METHYL8(2METHYLPROP2ENYLTHIO)137TRIHYDROPURINE26DIONE
7((E)BUT2ENYL)3METHYL8(2METHYLPROP2ENYLSULFANYL)PURINE26DIONE
7BUT2ENYL3METHYL8(2METHYLALLYLSULFANYL)37DIHYDROPURINE26DIONE
CC=CCn1c(SCC(=C)C)nc2c1c(=O)(nH)c(=O)n2C
CC=CCN1C2=C(N=C1SCC(=C)C)N(C(=O)NC2=O)C
InChI=1SC14H18N4O2Sc1567181011(1514(18)2189(2)3)17(4)13(20)1612(10)19h56H278H2134H3(H161920)b65+
MFCD01562106
ZINC000004785636
ZINC04785636
ZINC4785636
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