Vitas-M small molecule compound
2-{[4-ethyl-5-({[(4-methoxyphenyl)acetyl]amino}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-fluoro-2-methylphenyl)acetamide
Catalog ID
STK117371
SMILES COc1ccc(cc1)CC(=O)NCc1nnc(n1CC)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/c1-4-29-20(13-25-21(30)11-16-6-9-18(32-3)10-7-16)27-28-23(29)33-14-22(31)26-19-12-17(24)8-5-15(19)2/h5-10,12H,4,11,13-14H2,1-3H3,(H,25,30)(H,26,31)InChIKey
OPZRTZMSFAOCFX-UHFFFAOYSA-NSynonyms
2((4ETHYL5((((4METHOXYPHENYL)ACETYL)AMINO)METHYL)4H124TRIAZOL3YL)SULFANYL)N(5FLUORO2METHYLPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)F)C)CNC(=O)CC3=CC=C(C=C3)OC
InChI=1SC23H26FN5O3Sc142920(132521(30)11166918(323)10716)272823(29)331422(31)26191217(24)8515(19)2h51012H4111314H213H3(H2530)(H2631)
MFCD03995187
N((4ETHYL5(2(5FLUORO2METHYLANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)METHYL)2(4METHOXYPHENYL)ACETAMIDE
ZINC000001142294
ZINC01142294
ZINC1142294
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