Vitas-M small molecule compound
9-methyl-8-[({5-methyl-2-[4-(propan-2-yloxy)phenyl]-1,3-oxazol-4-yl}methyl)sulfanyl]-1,9-dihydro-6H-purin-6-one
Catalog ID
STK497031
SMILES CC(Oc1ccc(cc1)c1nc(c(o1)C)CSc1nc2c(n1C)nc[nH]c2=O)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 C20H21N5O3S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O3S/c1-11(2)27-14-7-5-13(6-8-14)19-23-15(12(3)28-19)9-29-20-24-16-17(25(20)4)21-10-22-18(16)26/h5-8,10-11H,9H2,1-4H3,(H,21,22,26)InChIKey
DZFXNMIAVKJPLY-UHFFFAOYSA-NSynonyms
9methyl8(((5methyl2(4(propan2yloxy)phenyl)13oxazol4yl)methyl)sulfanyl)19dihydro6Hpurin6one
9METHYL8((5METHYL2(4(METHYLETHOXY)PHENYL)(13OXAZOL4YL))METHYLTHIO)HYDROPURIN6ONE
9methyl8((5methyl2(4propan2yloxyphenyl)13oxazol4yl)methylsulfanyl)3Hpurin6one
CC(Oc1ccc(cc1)c1nc(c(o1)C)CSc1nc2c(n1C)nc(nH)c2=O)C
CC1=C(N=C(O1)C2=CC=C(C=C2)OC(C)C)CSC3=NC4=C(N3C)NC=NC4=O
InChI=1SC20H21N5O3Sc111(2)27147513(6814)192315(12(3)2819)92920241617(25(20)4)21102218(16)26h581011H9H214H3(H212226)
MFCD09788430
ZINC000012372645
ZINC12372645
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