Vitas-M small molecule compound
1-(4-phenyl-1,3-thiazol-2-yl)-3-(trifluoromethyl)-1,4-dihydrochromeno[4,3-c]pyrazole
Catalog ID
STL448577
SMILES FC(c1nn(c2c1COc1c2cccc1)c1scc(n1)c1ccccc1)(F)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 C20H12F3N3OS MW 399.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12F3N3OS/c21-20(22,23)18-14-10-27-16-9-5-4-8-13(16)17(14)26(25-18)19-24-15(11-28-19)12-6-2-1-3-7-12/h1-9,11H,10H2InChIKey
CETNFEFCRIOKSE-UHFFFAOYSA-NSynonyms
1(4phenyl13thiazol2yl)3(trifluoromethyl)14dihydrochromeno(43c)pyrazole
1(4phenyl13thiazol2yl)3(trifluoromethyl)4Hchromeno(43c)pyrazole
C1C2=C(C3=CC=CC=C3O1)N(N=C2C(F)(F)F)C4=NC(=CS4)C5=CC=CC=C5
InChI=1SC20H12F3N3OSc2120(2223)1814102716954813(16)17(14)26(2518)192415(112819)126213712h1911H10H2
MFCD07774007
ZINC000005274838
ZINC5274838
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