Vitas-M small molecule compound
8-({[2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9-methyl-1,9-dihydro-6H-purin-6-one
Catalog ID
STK497033
SMILES CCOc1ccc(cc1OC)c1nc(c(o1)C)CSc1nc2c(n1C)nc[nH]c2=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 C20H21N5O4S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4S/c1-5-28-14-7-6-12(8-15(14)27-4)19-23-13(11(2)29-19)9-30-20-24-16-17(25(20)3)21-10-22-18(16)26/h6-8,10H,5,9H2,1-4H3,(H,21,22,26)InChIKey
BEGBNXSTFAFESI-UHFFFAOYSA-NSynonyms
8(((2(4ethoxy3methoxyphenyl)5methyl13oxazol4yl)methyl)sulfanyl)9methyl19dihydro6Hpurin6one
8((2(4ETHOXY3METHOXYPHENYL)5METHYL(13OXAZOL4YL))METHYLTHIO)9METHYLHYDROPURIN6ONE
8((2(4ethoxy3methoxyphenyl)5methyl13oxazol4yl)methylsulfanyl)9methyl3Hpurin6one
CCOC1=C(C=C(C=C1)C2=NC(=C(O2)C)CSC3=NC4=C(N3C)NC=NC4=O)OC
CCOc1ccc(cc1OC)c1nc(c(o1)C)CSc1nc2c(n1C)nc(nH)c2=O
InChI=1SC20H21N5O4Sc1528147612(815(14)274)192313(11(2)2919)93020241617(25(20)3)21102218(16)26h6810H59H214H3(H212226)
MFCD09788432
ZINC000012412098
ZINC12412098
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