Vitas-M small molecule compound
ethyl N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-(pentanoylamino)alaninate
Catalog ID
STK764983
SMILES CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1sc2c(c1C#N)CCCC2
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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/c1-3-5-10-15(26)24-18(19(20,21)22,17(27)28-4-2)25-16-13(11-23)12-8-6-7-9-14(12)29-16/h25H,3-10H2,1-2H3,(H,24,26)InChIKey
KJNMVACUDHDZOI-UHFFFAOYSA-NSynonyms
447430-41-3(S)ethyl2((3cyano4567tetrahydrobenzo(b)thiophen2yl)amino)333trifluoro2pentanamidopropanoate
447430413
CCCCC(=O)NC(C(=O)OCC)(C(F)(F)F)NC1=C(C2=C(S1)CCCC2)C#N
ethyl2((3cyano4567tetrahydro1benzothiophen2yl)amino)333trifluoro2(pentanoylamino)propanoate
ethylN(3cyano4567tetrahydro1benzothiophen2yl)333trifluoro2(pentanoylamino)alaninate
InChI=1SC19H24F3N3O3Sc1351015(26)2418(19(2021)2217(27)2842)251613(1123)12867914(12)2916h25H310H212H3(H2426)
MFCD02933398
ZINC000002050540
ZINC000002050541
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