Vitas-M small molecule compound
ethyl N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-3,3,3-trifluoro-2-(pentanoylamino)alaninate
Catalog ID
STK542174
SMILES CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1sc2c(n1)c(C)c(cc2)Cl
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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 C18H21ClF3N3O3S MW 451.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClF3N3O3S/c1-4-6-7-13(26)24-17(18(20,21)22,15(27)28-5-2)25-16-23-14-10(3)11(19)8-9-12(14)29-16/h8-9H,4-7H2,1-3H3,(H,23,25)(H,24,26)InChIKey
GRNIZLNZFGHMJF-UHFFFAOYSA-NSynonyms
500279-11-8(S)ethyl2((5chloro4methylbenzo(d)thiazol2yl)amino)333trifluoro2pentanamidopropanoate
500279118
CCCCC(=O)NC(C(=O)OCC)(C(F)(F)F)NC1=NC2=C(S1)C=CC(=C2C)Cl
ETHYL2((5CHLORO4METHYL13BENZOTHIAZOL2YL)AMINO)333TRIFLUORO2(PENTANOYLAMINO)PROPANOATE
ETHYL2((5CHLORO4METHYL13BENZOTHIAZOL2YL)AMINO)333TRIFLUORONPENTANOYLALANINATE
ethylN(5chloro4methyl13benzothiazol2yl)333trifluoro2(pentanoylamino)alaninate
InChI=1SC18H21ClF3N3O3Sc146713(26)2417(18(2021)2215(27)2852)2516231410(3)11(19)8912(14)2916h89H47H213H3(H2325)(H2426)
MFCD03305310
ZINC000016956962
ZINC000016956964
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