Vitas-M small molecule compound
2-(2,6-dimethylphenoxy)-N-{[5-({2-[(5-fluoro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}acetamide
Catalog ID
STK119552
SMILES O=C(COc1c(C)cccc1C)NCc1nnc(n1C)SCC(=O)Nc1cc(F)ccc1C
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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 C23H26FN5O3S MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26FN5O3S/c1-14-8-9-17(24)10-18(14)26-21(31)13-33-23-28-27-19(29(23)4)11-25-20(30)12-32-22-15(2)6-5-7-16(22)3/h5-10H,11-13H2,1-4H3,(H,25,30)(H,26,31)InChIKey
GJQSJZQQUMCXRP-UHFFFAOYSA-NSynonyms
2(26DIMETHYLPHENOXY)N((5((2((5FLUORO2METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)ACETAMIDE
2(26DIMETHYLPHENOXY)N((5(2(5FLUORO2METHYLANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)ACETAMIDE
CC1=C(C(=CC=C1)C)OCC(=O)NCC2=NN=C(N2C)SCC(=O)NC3=C(C=CC(=C3)F)C
InChI=1SC23H26FN5O3Sc1148917(24)1018(14)2621(31)133323282719(29(23)4)112520(30)12322215(2)65716(22)3h510H1113H214H3(H2530)(H2631)
MFCD03721796
ZINC000001132667
ZINC01132667
ZINC1132667
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