Vitas-M small molecule compound
7-(2-chlorobenzyl)-6-hydroxy-3-methyl-8-[(3-oxobutan-2-yl)sulfanyl]-3,7-dihydro-2H-purin-2-one
Catalog ID
STK574833
SMILES CC(=O)C(Sc1nc2c(n1Cc1ccccc1Cl)c(O)nc(=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 C17H17ClN4O3S MW 392.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4O3S/c1-9(23)10(2)26-17-19-14-13(15(24)20-16(25)21(14)3)22(17)8-11-6-4-5-7-12(11)18/h4-7,10H,8H2,1-3H3,(H,20,24,25)InChIKey
WRRSKRILRGRDLX-UHFFFAOYSA-NSynonyms
402470-63-7402470637
7((2CHLOROPHENYL)METHYL)3METHYL8(3OXOBUTAN2YLSULFANYL)PURINE26DIONE
7(2CHLOROBENZYL)3METHYL8((3OXOBUTAN2YL)THIO)1HPURINE26(3H7H)DIONE
7(2chlorobenzyl)6hydroxy3methyl8((3oxobutan2yl)sulfanyl)37dihydro2Hpurin2one
CC(C(=O)C)SC1=NC2=C(N1CC3=CC=CC=C3Cl)C(=O)NC(=O)N2C
InChI=1SC17H17ClN4O3Sc19(23)10(2)2617191413(15(24)2016(25)21(14)3)22(17)811645712(11)18h4710H8H213H3(H202425)
MFCD07199885
ZINC000002340435
ZINC000002340436
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