Vitas-M small molecule compound
8-[(2-chlorobenzyl)sulfanyl]-7-hexyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK540331
SMILES CCCCCCn1c(SCc2ccccc2Cl)nc2c1c(=O)n(c(=O)n2C)C
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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/c1-4-5-6-9-12-25-16-17(23(2)20(27)24(3)18(16)26)22-19(25)28-13-14-10-7-8-11-15(14)21/h7-8,10-11H,4-6,9,12-13H2,1-3H3InChIKey
VBXBDDNMZWGEPK-UHFFFAOYSA-NSynonyms
370869-92-4370869924
8((2chlorobenzyl)sulfanyl)7hexyl13dimethyl37dihydro1Hpurine26dione
8((2CHLOROBENZYL)THIO)7HEXYL13DIMETHYL1HPURINE26(3H7H)DIONE
8((2CHLOROPHENYL)METHYLSULFANYL)7HEXYL13DIMETHYLPURINE26DIONE
CCCCCCN1C2=C(N=C1SCC3=CC=CC=C3Cl)N(C(=O)N(C2=O)C)C
InChI=1SC20H25ClN4O2Sc1456912251617(23(2)20(27)24(3)18(16)26)2219(25)28131410781115(14)21h781011H4691213H213H3
MFCD03010585
ZINC000012377509
ZINC12377509
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