Vitas-M small molecule compound
ethyl 2-{butan-2-yl[(2E)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-enoyl]amino}-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate
Catalog ID
STL396406
SMILES CCOC(=O)c1sc(nc1C(F)(F)F)N(C(=O)/C=C/c1cnn(c1C)C)C(CC)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 C19H23F3N4O3S MW 444.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23F3N4O3S/c1-6-11(3)26(14(27)9-8-13-10-23-25(5)12(13)4)18-24-16(19(20,21)22)15(30-18)17(28)29-7-2/h8-11H,6-7H2,1-5H3/b9-8+InChIKey
UDVVZKBZXCDPKV-CMDGGOBGSA-NSynonyms
1006358-03-71006358037
CCC(C)N(C1=NC(=C(S1)C(=O)OCC)C(F)(F)F)C(=O)C=CC2=C(N(N=C2)C)C
CCOC(=O)c1sc(nc1C(F)(F)F)N(C(=O)C=Cc1cnn(c1C)C)C(CC)C
ETHYL2(BUTAN2YL((2E)3(15DIMETHYL1HPYRAZOL4YL)PROP2ENOYL)AMINO)4(TRIFLUOROMETHYL)13THIAZOLE5CARBOXYLATE
ethyl2(butan2yl((E)3(15dimethylpyrazol4yl)prop2enoyl)amino)4(trifluoromethyl)13thiazole5carboxylate
InChI=1SC19H23F3N4O3Sc1611(3)26(14(27)9813102325(5)12(13)4)182416(19(2021)22)15(3018)17(28)2972h811H67H215H3b98+
MFCD08554405
ZINC000019640449
ZINC000019640454
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