Vitas-M small molecule compound
1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-[(E)-2-(4-methoxyphenyl)ethenyl]-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
Catalog ID
STL440002
SMILES COc1ccc(cc1)/C=C/C1=NN(C(C1)(O)C(F)(F)F)c1scc(n1)c1ccc(cc1)F
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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 C22H17F4N3O2S MW 463.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F4N3O2S/c1-31-18-10-3-14(4-11-18)2-9-17-12-21(30,22(24,25)26)29(28-17)20-27-19(13-32-20)15-5-7-16(23)8-6-15/h2-11,13,30H,12H2,1H3/b9-2+InChIKey
KNZLPCKSGUOLNU-XNWCZRBMSA-NSynonyms
1(4(4fluorophenyl)13thiazol2yl)3((E)2(4methoxyphenyl)ethenyl)5(trifluoromethyl)45dihydro1Hpyrazol5ol
2(4(4FLUOROPHENYL)13THIAZOL2YL)5((E)2(4METHOXYPHENYL)ETHENYL)3(TRIFLUOROMETHYL)4HPYRAZOL3OL
COC1=CC=C(C=C1)C=CC2=NN(C(C2)(C(F)(F)F)O)C3=NC(=CS3)C4=CC=C(C=C4)F
COc1ccc(cc1)C=CC1=NN(C(C1)(O)C(F)(F)F)c1scc(n1)c1ccc(cc1)F
InChI=1SC22H17F4N3O2Sc1311810314(41118)29171221(3022(2425)26)29(2817)202719(133220)155716(23)8615h2111330H12H21H3b92+
MFCD06240723
ZINC000008754084
ZINC000008754091
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