Vitas-M small molecule compound
3-(4-methoxyphenyl)-5-({[4-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazole
Catalog ID
STK279391
SMILES COc1ccc(cc1)c1noc(n1)CSc1nnc(n1C)c1ccc2c(c1)CCCC2
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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 C23H23N5O2S MW 433.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O2S/c1-28-22(18-8-7-15-5-3-4-6-17(15)13-18)25-26-23(28)31-14-20-24-21(27-30-20)16-9-11-19(29-2)12-10-16/h7-13H,3-6,14H2,1-2H3InChIKey
UJBMJJIQTGSIKO-UHFFFAOYSA-NSynonyms
3(4methoxyphenyl)5(((4methyl5(5678tetrahydronaphthalen2yl)4H124triazol3yl)sulfanyl)methyl)124oxadiazole
3(4methoxyphenyl)5((4methyl5(5678tetrahydronaphthalen2yl)124triazol3yl)sulfanylmethyl)124oxadiazole
CN1C(=NN=C1SCC2=NC(=NO2)C3=CC=C(C=C3)OC)C4=CC5=C(CCCC5)C=C4
InChI=1SC23H23N5O2Sc12822(188715534617(15)1318)252623(28)3114202421(273020)1691119(292)121016h713H3614H212H3
MFCD09269829
ZINC000009193301
ZINC09193301
ZINC9193301
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