Vitas-M small molecule compound
7-(2-chlorobenzyl)-8-(heptylsulfanyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK642658
SMILES CCCCCCCSc1nc2c(n1Cc1ccccc1Cl)c(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 C20H25ClN4O2S MW 420.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN4O2S/c1-3-4-5-6-9-12-28-20-22-17-16(18(26)23-19(27)24(17)2)25(20)13-14-10-7-8-11-15(14)21/h7-8,10-11H,3-6,9,12-13H2,1-2H3,(H,23,26,27)InChIKey
SBGWWNFOLAOJHU-UHFFFAOYSA-NSynonyms
331841-40-8331841408
7((2CHLOROPHENYL)METHYL)8HEPTYLSULFANYL3METHYLPURINE26DIONE
7((2CHLOROPHENYL)METHYL)8HEPTYLTHIO3METHYL137TRIHYDROPURINE26DIONE
7(2CHLOROBENZYL)8(HEPTYLSULFANYL)3METHYL37DIHYDRO1HPURINE26DIONE
7(2chlorobenzyl)8(heptylsulfanyl)6hydroxy3methyl37dihydro2Hpurin2one
7(2CHLOROBENZYL)8HEPTYLSULFANYL3METHYL37DIHYDROPURINE26DIONE
CCCCCCCSC1=NC2=C(N1CC3=CC=CC=C3Cl)C(=O)NC(=O)N2C
InChI=1SC20H25ClN4O2Sc134569122820221716(18(26)2319(27)24(17)2)25(20)131410781115(14)21h781011H3691213H212H3(H232627)
MFCD18163042
ZINC000008424628
ZINC08424628
ZINC8424628
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