Vitas-M small molecule compound
ethyl 3,3,3-trifluoro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(pentanoylamino)alaninate
Catalog ID
STK547949
SMILES CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1nc2c(s1)cc(cc2)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 C18H22F3N3O3S MW 417.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22F3N3O3S/c1-4-6-7-14(25)23-17(18(19,20)21,15(26)27-5-2)24-16-22-12-9-8-11(3)10-13(12)28-16/h8-10H,4-7H2,1-3H3,(H,22,24)(H,23,25)InChIKey
YEQKDWXGBDBACU-UHFFFAOYSA-NSynonyms
488135-88-2(S)ethyl333trifluoro2((6methylbenzo(d)thiazol2yl)amino)2pentanamidopropanoate
488135882
CCCCC(=O)NC(C(=O)OCC)(C(F)(F)F)NC1=NC2=C(S1)C=C(C=C2)C
ETHYL333TRIFLUORO2((6METHYL13BENZOTHIAZOL2YL)AMINO)2(PENTANOYLAMINO)PROPANOATE
ETHYL333TRIFLUORO2((6METHYL13BENZOTHIAZOL2YL)AMINO)NPENTANOYLALANINATE
ETHYL333TRIFLUORO2((6METHYL13BENZOTHIAZOL2YL)AMINO)NPENTANOYLLALANINATE
ethyl333trifluoroN(6methyl13benzothiazol2yl)2(pentanoylamino)alaninate
InChI=1SC18H22F3N3O3Sc146714(25)2317(18(1920)2115(26)2752)241622129811(3)1013(12)2816h810H47H213H3(H2224)(H2325)
MFCD03067337
ZINC000009111619
ZINC000009111620
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