Vitas-M small molecule compound
methyl 2-(acetylamino)-3,3,3-trifluoro-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]alaninate
Catalog ID
STK679381
SMILES COC(=O)C(C(F)(F)F)(Nc1nc2c(s1)cc(cc2)OC(F)(F)F)NC(=O)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 C14H11F6N3O4S MW 431.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11F6N3O4S/c1-6(24)22-12(10(25)26-2,13(15,16)17)23-11-21-8-4-3-7(5-9(8)28-11)27-14(18,19)20/h3-5H,1-2H3,(H,21,23)(H,22,24)InChIKey
HRQBVDHBRPKBQB-UHFFFAOYSA-NSynonyms
CC(=O)NC(C(=O)OC)(C(F)(F)F)NC1=NC2=C(S1)C=C(C=C2)OC(F)(F)F
InChI=1SC14H11F6N3O4Sc16(24)2212(10(25)26213(1516)17)2311218437(59(8)2811)2714(1819)20h35H12H3(H2123)(H2224)
methyl2(acetylamino)333trifluoroN(6(trifluoromethoxy)13benzothiazol2yl)alaninate
METHYL2ACETAMIDO333TRIFLUORO2((6(TRIFLUOROMETHOXY)13BENZOTHIAZOL2YL)AMINO)PROPANOATE
MFCD03409361
PROPIONICACID2ACETYLAMINO333TRIFLUORO2(6TRIFLUOROMETHOXYBENZOTHIAZOL2YLAMINO)METHYLESTER
ZINC000003622328
ZINC000003622331
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