Vitas-M small molecule compound
ethyl N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3,3,3-trifluoro-2-(pentanoylamino)alaninate
Catalog ID
STK771425
SMILES CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1sc2c(n1)c(C)cc(c2)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 C19H24F3N3O3S MW 431.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24F3N3O3S/c1-5-7-8-14(26)24-18(19(20,21)22,16(27)28-6-2)25-17-23-15-12(4)9-11(3)10-13(15)29-17/h9-10H,5-8H2,1-4H3,(H,23,25)(H,24,26)InChIKey
CBNAEDYPLDQSSM-UHFFFAOYSA-NSynonyms
500273-37-0(S)ethyl2((46dimethylbenzo(d)thiazol2yl)amino)333trifluoro2pentanamidopropanoate
500273370
CCCCC(=O)NC(C(=O)OCC)(C(F)(F)F)NC1=NC2=C(C=C(C=C2S1)C)C
ETHYL2((46DIMETHYL13BENZOTHIAZOL2YL)AMINO)333TRIFLUORO2(PENTANOYLAMINO)PROPANOATE
ETHYL2((46DIMETHYL13BENZOTHIAZOL2YL)AMINO)333TRIFLUORONPENTANOYLALANINATE
ethylN(46dimethyl13benzothiazol2yl)333trifluoro2(pentanoylamino)alaninate
InChI=1SC19H24F3N3O3Sc157814(26)2418(19(2021)2216(27)2862)2517231512(4)911(3)1013(15)2917h910H58H214H3(H2325)(H2426)
MFCD03302950
ZINC000009111579
ZINC000009111580
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