Vitas-M small molecule compound
5-bromo-2-methoxy-N-{[2-(piperidin-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide
Catalog ID
STK251925
SMILES COc1ccc(cc1C(=O)NC(=S)Nc1cc(ccc1N1CCCCC1)C(F)(F)F)Br
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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 C21H21BrF3N3O2S MW 516.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrF3N3O2S/c1-30-18-8-6-14(22)12-15(18)19(29)27-20(31)26-16-11-13(21(23,24)25)5-7-17(16)28-9-3-2-4-10-28/h5-8,11-12H,2-4,9-10H2,1H3,(H2,26,27,29,31)InChIKey
FLCSPEQYXUJAJC-UHFFFAOYSA-NSynonyms
(5BROMO2METHOXYPHENYL)N(((2PIPERIDYL5(TRIFLUOROMETHYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
5BROMO2METHOXYN((2(PIPERIDIN1YL)5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
5BROMO2METHOXYN((2PIPERIDIN1YL5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3
InChI=1SC21H21BrF3N3O2Sc130188614(22)1215(18)19(29)2720(31)26161113(21(2324)25)5717(16)2893241028h581112H24910H21H3(H226272931)
MFCD03650056
ZINC000001852618
ZINC01852618
ZINC1852618
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