Vitas-M small molecule compound
5-bromo-2-chloro-N-{[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK243910
SMILES S=C(NC(=O)c1cc(Br)ccc1Cl)Nc1ccc2c(c1)nc(o2)c1ccc(cc1Cl)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 C21H11BrCl2FN3O2S MW 539.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11BrCl2FN3O2S/c22-10-1-5-15(23)14(7-10)19(29)28-21(31)26-12-3-6-18-17(9-12)27-20(30-18)13-4-2-11(25)8-16(13)24/h1-9H,(H2,26,28,29,31)InChIKey
JTKAWYPATXKRKH-UHFFFAOYSA-NSynonyms
5bromo2chloroN((2(2chloro4fluorophenyl)13benzoxazol5yl)carbamothioyl)benzamide
C1=CC2=C(C=C1NC(=S)NC(=O)C3=C(C=CC(=C3)Br)Cl)N=C(O2)C4=C(C=C(C=C4)F)Cl
InChI=1SC21H11BrCl2FN3O2Sc22101515(23)14(710)19(29)2821(31)2612361817(912)2720(3018)134211(25)816(13)24h19H(H226282931)
MFCD03926185
ZINC000100339570
ZINC100339570
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