Vitas-M small molecule compound
methyl 2-(acetylamino)-N-(6-bromo-1,3-benzothiazol-2-yl)-3,3,3-trifluoroalaninate
Catalog ID
STK771435
SMILES COC(=O)C(C(F)(F)F)(Nc1nc2c(s1)cc(cc2)Br)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 C13H11BrF3N3O3S MW 426.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11BrF3N3O3S/c1-6(21)19-12(10(22)23-2,13(15,16)17)20-11-18-8-4-3-7(14)5-9(8)24-11/h3-5H,1-2H3,(H,18,20)(H,19,21)InChIKey
PKHMOWAMNDDRME-UHFFFAOYSA-NSynonyms
488801-88-3(S)methyl2acetamido2((6bromobenzo(d)thiazol2yl)amino)333trifluoropropanoate
2ACETYLAMINO2(6BROMOBENZOTHIAZOL2YLAMINO)333TRIFLUOROPROPIONICACIDMETHYLESTER
488801883
CC(=O)NC(C(=O)OC)(C(F)(F)F)NC1=NC2=C(S1)C=C(C=C2)Br
InChI=1SC13H11BrF3N3O3Sc16(21)1912(10(22)23213(1516)17)2011188437(14)59(8)2411h35H12H3(H1820)(H1921)
METHYL2(ACETYLAMINO)2((6BROMO13BENZOTHIAZOL2YL)AMINO)333TRIFLUOROPROPANOATE
methyl2(acetylamino)N(6bromo13benzothiazol2yl)333trifluoroalaninate
METHYL2ACETAMIDO2((6BROMO13BENZOTHIAZOL2YL)AMINO)333TRIFLUOROPROPANOATE
MFCD03293049
ZINC000008997071
ZINC000008997072
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