Vitas-M small molecule compound
2-chloro-N-{[2-(2-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-4-fluorobenzamide
Catalog ID
STK236927
SMILES S=C(NC(=O)c1ccc(cc1Cl)F)Nc1ccc2c(c1)nc(o2)c1ccc(cc1Cl)C
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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 C22H14Cl2FN3O2S MW 474.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14Cl2FN3O2S/c1-11-2-5-15(16(23)8-11)21-27-18-10-13(4-7-19(18)30-21)26-22(31)28-20(29)14-6-3-12(25)9-17(14)24/h2-10H,1H3,(H2,26,28,29,31)InChIKey
JRCBEPHQENTIGP-UHFFFAOYSA-NSynonyms
2chloroN((2(2chloro4methylphenyl)13benzoxazol5yl)carbamothioyl)4fluorobenzamide
CC1=CC(=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=C(C=C(C=C4)F)Cl)Cl
InChI=1SC22H14Cl2FN3O2Sc1112515(16(23)811)2127181013(4719(18)3021)2622(31)2820(29)146312(25)917(14)24h210H1H3(H226282931)
MFCD03906778
ZINC000009190388
ZINC09190388
ZINC9190388
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