Vitas-M small molecule compound
3-methyl-8-[(2-oxopropyl)sulfanyl]-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK805443
SMILES C=CCn1c(SCC(=O)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 C12H14N4O3S MW 294.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4O3S/c1-4-5-16-8-9(13-12(16)20-6-7(2)17)15(3)11(19)14-10(8)18/h4H,1,5-6H2,2-3H3,(H,14,18,19)InChIKey
UUDMDBLEEDWUBZ-UHFFFAOYSA-NSynonyms
331841-70-4331841704
3methyl8((2oxopropyl)sulfanyl)7(prop2en1yl)37dihydro1Hpurine26dione
3METHYL8(2OXOPROPYLSULFANYL)7PROP2ENYLPURINE26DIONE
3METHYL8(2OXOPROPYLTHIO)7PROP2ENYL137TRIHYDROPURINE26DIONE
7ALLYL3METHYL8((2OXOPROPYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
7allyl3methyl8((2oxopropyl)thio)1Hpurine26(3H7H)dione
7ALLYL3METHYL8(2OXOPROPYLSULFANYL)37DIHYDROPURINE26DIONE
C=CCn1c(SCC(=O)C)nc2c1c(=O)(nH)c(=O)n2C
CC(=O)CSC1=NC2=C(N1CC=C)C(=O)NC(=O)N2C
InChI=1SC12H14N4O3Sc1451689(1312(16)2067(2)17)15(3)11(19)1410(8)18h4H156H223H3(H141819)
MFCD01051781
ZINC000000304873
ZINC00304873
ZINC304873
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