Vitas-M small molecule compound
7-butyl-8-[(2-chlorobenzyl)sulfanyl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK643767
SMILES CCCCn1c(SCc2ccccc2Cl)nc2c1c(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 C17H19ClN4O2S MW 378.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN4O2S/c1-3-4-9-22-13-14(21(2)16(24)20-15(13)23)19-17(22)25-10-11-7-5-6-8-12(11)18/h5-8H,3-4,9-10H2,1-2H3,(H,20,23,24)InChIKey
JNFINTAOXOVXES-UHFFFAOYSA-NSynonyms
332103-34-17butyl8((2chlorobenzyl)sulfanyl)6hydroxy3methyl37dihydro2Hpurin2one
7BUTYL8((2CHLOROBENZYL)THIO)3METHYL1HPURINE26(3H7H)DIONE
7BUTYL8((2CHLOROPHENYL)METHYLSULFANYL)3METHYLPURINE26DIONE
7BUTYL8((2CHLOROPHENYL)METHYLTHIO)3METHYL137TRIHYDROPURINE26DIONE
7BUTYL8(2CHLOROBENZYLSULFANYL)3METHYL37DIHYDROPURINE26DIONE
CCCCN1C2=C(N=C1SCC3=CC=CC=C3Cl)N(C(=O)NC2=O)C
InChI=1SC17H19ClN4O2Sc1349221314(21(2)16(24)2015(13)23)1917(22)251011756812(11)18h58H34910H212H3(H202324)
MFCD18163418
ZINC02063827
ZINC2063827
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