Vitas-M small molecule compound
1-{1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl}-3-ethyl-1-(4-methoxyphenyl)thiourea
Catalog ID
STK689014
SMILES CCNC(=S)N(c1ccc(cc1)OC)C1CCN(CC1)c1ncc(cc1Cl)C(F)(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 C21H24ClF3N4OS MW 472.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClF3N4OS/c1-3-26-20(31)29(15-4-6-17(30-2)7-5-15)16-8-10-28(11-9-16)19-18(22)12-14(13-27-19)21(23,24)25/h4-7,12-13,16H,3,8-11H2,1-2H3,(H,26,31)InChIKey
CJEZNTPHGCZWLQ-UHFFFAOYSA-NSynonyms
1(1(3CHLORO5(TRIFLUOROMETHYL)PYRIDIN2YL)PIPERIDIN4YL)3ETHYL1(4METHOXYPHENYL)THIOUREA
CCNC(=S)N(C1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl)C3=CC=C(C=C3)OC
InChI=1SC21H24ClF3N4OSc132620(31)29(154617(302)7515)1681028(11916)1918(22)1214(132719)21(2324)25h47121316H3811H212H3(H2631)
MFCD07800174
ZINC000015024122
ZINC15024122
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