Vitas-M small molecule compound
8-[(4-chlorobenzyl)sulfanyl]-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK805693
SMILES CCCCCCn1c(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 C19H23ClN4O2S MW 406.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23ClN4O2S/c1-3-4-5-6-11-24-15-16(23(2)18(26)22-17(15)25)21-19(24)27-12-13-7-9-14(20)10-8-13/h7-10H,3-6,11-12H2,1-2H3,(H,22,25,26)InChIKey
PTBKHRHSIIOBKN-UHFFFAOYSA-NSynonyms
328068-88-8328068888
8((4chlorobenzyl)sulfanyl)7hexyl3methyl37dihydro1Hpurine26dione
8((4chlorobenzyl)thio)7hexyl3methyl1Hpurine26(3H7H)dione
8((4CHLOROPHENYL)METHYLSULFANYL)7HEXYL3METHYLPURINE26DIONE
8((4CHLOROPHENYL)METHYLTHIO)7HEXYL3METHYL137TRIHYDROPURINE26DIONE
8(4CHLOROBENZYLSULFANYL)7HEXYL3METHYL37DIHYDROPURINE26DIONE
CCCCCCn1c(SCc2ccc(cc2)Cl)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCN1C2=C(N=C1SCC3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C
InChI=1SC19H23ClN4O2Sc1345611241516(23(2)18(26)2217(15)25)2119(24)2712137914(20)10813h710H361112H212H3(H222526)
MFCD01186354
ZINC000002060828
ZINC02060828
ZINC2060828
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