Vitas-M small molecule compound
7-(2-chlorobenzyl)-8-(hexylsulfanyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK535613
SMILES CCCCCCSc1nc2c(n1Cc1ccccc1Cl)c(=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/c1-4-5-6-9-12-28-19-22-17-16(18(26)24(3)20(27)23(17)2)25(19)13-14-10-7-8-11-15(14)21/h7-8,10-11H,4-6,9,12-13H2,1-3H3InChIKey
GDAUIJNEVMRSNP-UHFFFAOYSA-NSynonyms
374615-76-6374615766
7((2CHLOROPHENYL)METHYL)8HEXYLSULFANYL13DIMETHYLPURINE26DIONE
7((2CHLOROPHENYL)METHYL)8HEXYLTHIO13DIMETHYL137TRIHYDROPURINE26DIONE
7(2chlorobenzyl)8(hexylsulfanyl)13dimethyl37dihydro1Hpurine26dione
7(2chlorobenzyl)8(hexylthio)13dimethyl1Hpurine26(3H7H)dione
CCCCCCSC1=NC2=C(N1CC3=CC=CC=C3Cl)C(=O)N(C(=O)N2C)C
InChI=1SC20H25ClN4O2Sc14569122819221716(18(26)24(3)20(27)23(17)2)25(19)131410781115(14)21h781011H4691213H213H3
MFCD01960110
ZINC000001808806
ZINC01808806
ZINC1808806
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