Vitas-M small molecule compound
(5E)-5-(3-{[3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]methyl}-4-methoxybenzylidene)-3-ethyl-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
Catalog ID
STL396454
SMILES CCN1C(=N/C(=C/c2ccc(c(c2)Cn2nc(cc2C(F)F)C(F)F)OC)/C1=O)S
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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 C19H18F4N4O2S MW 442.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18F4N4O2S/c1-3-26-18(28)13(24-19(26)30)7-10-4-5-15(29-2)11(6-10)9-27-14(17(22)23)8-12(25-27)16(20)21/h4-8,16-17H,3,9H2,1-2H3,(H,24,30)/b13-7+InChIKey
UPEZBGNKNCCFIO-NTUHNPAUSA-NSynonyms
1005615-52-0(5E)5((3((35bis(difluoromethyl)pyrazol1yl)methyl)4methoxyphenyl)methylidene)3ethyl2sulfanylideneimidazolidin4one
(5E)5(3((35BIS(DIFLUOROMETHYL)1HPYRAZOL1YL)METHYL)4METHOXYBENZYLIDENE)3ETHYL2SULFANYL35DIHYDRO4HIMIDAZOL4ONE
1005615520
CCN1C(=NC(=Cc2ccc(c(c2)Cn2nc(cc2C(F)F)C(F)F)OC)C1=O)S
CCN1C(=O)C(=CC2=CC(=C(C=C2)OC)CN3C(=CC(=N3)C(F)F)C(F)F)NC1=S
InChI=1SC19H18F4N4O2Sc132618(28)13(2419(26)30)7104515(292)11(610)92714(17(22)23)812(2527)16(20)21h481617H39H212H3(H2430)b137+
MFCD04135987
ZINC000019635641
ZINC19635641
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