Vitas-M small molecule compound
7-[(2E)-but-2-en-1-yl]-8-[(4-fluorobenzyl)sulfanyl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK564545
SMILES C/C=C/Cn1c(SCc2ccc(cc2)F)nc2c1c(O)nc(=O)n2C
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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 C17H17FN4O2S MW 360.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17FN4O2S/c1-3-4-9-22-13-14(21(2)16(24)20-15(13)23)19-17(22)25-10-11-5-7-12(18)8-6-11/h3-8H,9-10H2,1-2H3,(H,20,23,24)/b4-3+InChIKey
AGLMCSWROBBXEQ-ONEGZZNKSA-NSynonyms
CC=CCn1c(SCc2ccc(cc2)F)nc2c1c(O)nc(=O)n2C
MFCD03802813
ZINC000012647487
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