Vitas-M small molecule compound
3-bromo-4-ethoxy-N-{[2-(piperidin-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide
Catalog ID
STK251903
SMILES CCOc1ccc(cc1Br)C(=O)NC(=S)Nc1cc(ccc1N1CCCCC1)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 C22H23BrF3N3O2S MW 530.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrF3N3O2S/c1-2-31-19-9-6-14(12-16(19)23)20(30)28-21(32)27-17-13-15(22(24,25)26)7-8-18(17)29-10-4-3-5-11-29/h6-9,12-13H,2-5,10-11H2,1H3,(H2,27,28,30,32)InChIKey
KCGLVEFKROYKIL-UHFFFAOYSA-NSynonyms
(3BROMO4ETHOXYPHENYL)N(((2PIPERIDYL5(TRIFLUOROMETHYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
3BROMO4ETHOXYN((2(PIPERIDIN1YL)5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
3BROMO4ETHOXYN((2PIPERIDIN1YL5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3)Br
InChI=1SC22H23BrF3N3O2Sc1231199614(1216(19)23)20(30)2821(32)27171315(22(2425)26)7818(17)29104351129h691213H251011H21H3(H227283032)
MFCD03650053
ZINC000001850254
ZINC1850254
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