Vitas-M small molecule compound
8-({[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one
Catalog ID
STK497057
SMILES COc1cc(ccc1OC)c1oc(c(n1)CSc1nc2c(n1c1ccc(cc1)C)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 C25H23N5O4S MW 489.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O4S/c1-14-5-8-17(9-6-14)30-22-21(23(31)27-13-26-22)29-25(30)35-12-18-15(2)34-24(28-18)16-7-10-19(32-3)20(11-16)33-4/h5-11,13H,12H2,1-4H3,(H,26,27,31)InChIKey
YONVAMYEXVEOIK-UHFFFAOYSA-NSynonyms
8(((2(34dimethoxyphenyl)5methyl13oxazol4yl)methyl)sulfanyl)9(4methylphenyl)19dihydro6Hpurin6one
8((2(34DIMETHOXYPHENYL)5METHYL(13OXAZOL4YL))METHYLTHIO)9(4METHYLPHENYL)HYDROPURIN6ONE
8((2(34dimethoxyphenyl)5methyl13oxazol4yl)methylsulfanyl)9(4methylphenyl)3Hpurin6one
CC1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC4=C(OC(=N4)C5=CC(=C(C=C5)OC)OC)C
COc1cc(ccc1OC)c1oc(c(n1)CSc1nc2c(n1c1ccc(cc1)C)nc(nH)c2=O)C
InChI=1SC25H23N5O4Sc1145817(9614)302221(23(31)27132622)2925(30)35121815(2)3424(2818)1671019(323)20(1116)334h51113H12H214H3(H262731)
MFCD09788453
ZINC000012462141
ZINC12462141
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