Vitas-M small molecule compound
8-[(4-chlorobenzyl)sulfanyl]-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK700241
SMILES CCCCCCCCn1c(SCc2ccc(cc2)Cl)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 C21H27ClN4O2S MW 434.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27ClN4O2S/c1-3-4-5-6-7-8-13-26-17-18(25(2)20(28)24-19(17)27)23-21(26)29-14-15-9-11-16(22)12-10-15/h9-12H,3-8,13-14H2,1-2H3,(H,24,27,28)InChIKey
OYFAZHAGBVYIGK-UHFFFAOYSA-NSynonyms
331842-87-6331842876
8((4chlorobenzyl)sulfanyl)3methyl7octyl37dihydro1Hpurine26dione
8((4chlorobenzyl)thio)3methyl7octyl1Hpurine26(3H7H)dione
8((4CHLOROPHENYL)METHYLSULFANYL)3METHYL7OCTYLPURINE26DIONE
8((4CHLOROPHENYL)METHYLTHIO)3METHYL7OCTYL137TRIHYDROPURINE26DIONE
8(4CHLOROBENZYLSULFANYL)3METHYL7OCTYL37DIHYDROPURINE26DIONE
CCCCCCCCn1c(SCc2ccc(cc2)Cl)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCN1C2=C(N=C1SCC3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C
InChI=1SC21H27ClN4O2Sc134567813261718(25(2)20(28)2419(17)27)2321(26)29141591116(22)121015h912H381314H212H3(H242728)
MFCD01051783
ZINC000008424641
ZINC08424641
ZINC8424641
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