Vitas-M small molecule compound
7-(2-chlorobenzyl)-8-[(2-hydroxypropyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK806006
SMILES CC(CSc1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C)O
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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 C16H17ClN4O3S MW 380.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4O3S/c1-9(22)8-25-16-18-13-12(14(23)19-15(24)20(13)2)21(16)7-10-5-3-4-6-11(10)17/h3-6,9,22H,7-8H2,1-2H3,(H,19,23,24)InChIKey
CQDYYFRRTLJVOQ-UHFFFAOYSA-NSynonyms
327168-99-0327168990
7((2CHLOROPHENYL)METHYL)8(2HYDROXYPROPYLSULFANYL)3METHYLPURINE26DIONE
7(2chlorobenzyl)8((2hydroxypropyl)sulfanyl)3methyl37dihydro1Hpurine26dione
7(2chlorobenzyl)8((2hydroxypropyl)thio)3methyl1Hpurine26(3H7H)dione
7(2CHLOROBENZYL)8(2HYDROXYPROPYLSULFANYL)3METHYL37DIHYDROPURINE26DIONE
CC(CSC1=NC2=C(N1CC3=CC=CC=C3Cl)C(=O)NC(=O)N2C)O
CC(CSc1nc2c(n1Cc1ccccc1Cl)c(=O)(nH)c(=O)n2C)O
InChI=1SC16H17ClN4O3Sc19(22)82516181312(14(23)1915(24)20(13)2)21(16)710534611(10)17h36922H78H212H3(H192324)
MFCD01051716
ZINC000000628037
ZINC000000628039
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