Vitas-M small molecule compound

6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-8-sulfanyl-3,7-dihydro-2H-purin-2-one

Catalog ID
STK599003
SMILES OC(Cn1c(S)nc2c1c(O)nc(=O)n2C)COc1cccc(c1)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 C16H18N4O4S MW 362.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O4S/c1-9-4-3-5-11(6-9)24-8-10(21)7-20-12-13(17-16(20)25)19(2)15(23)18-14(12)22/h3-6,10,21H,7-8H2,1-2H3,(H,17,25)(H,18,22,23)
InChIKey
RQIFATLIQUSINB-UHFFFAOYSA-N
Synonyms
850731-94-1
850731941
MFCD07200296
ZINC000101225025
ZINC000101225030

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.