Vitas-M small molecule compound
1-(2-chlorobenzyl)-8-(ethylsulfanyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK137267
SMILES CCSc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1Cl
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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 C16H17ClN4O2S MW 364.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4O2S/c1-4-24-15-18-13-12(19(15)2)14(22)21(16(23)20(13)3)9-10-7-5-6-8-11(10)17/h5-8H,4,9H2,1-3H3InChIKey
PZFNCDONVRVRQB-UHFFFAOYSA-NSynonyms
1((2CHLOROPHENYL)METHYL)8ETHYLSULFANYL37DIMETHYLPURINE26DIONE
1(2CHLOROBENZYL)8(ETHYLSULFANYL)37DIMETHYL37DIHYDRO1HPURINE26DIONE
CCSC1=NC2=C(N1C)C(=O)N(C(=O)N2C)CC3=CC=CC=C3Cl
InChI=1SC16H17ClN4O2Sc142415181312(19(15)2)14(22)21(16(23)20(13)3)910756811(10)17h58H49H213H3
MFCD03271141
ZINC000001135270
ZINC01135270
ZINC1135270
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