Vitas-M small molecule compound

methyl 3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]-N-(phenylcarbonyl)alaninate

Catalog ID
STK771495
SMILES COC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)Nc1scc(n1)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 C15H14F3N3O3S MW 373.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14F3N3O3S/c1-9-8-25-13(19-9)21-14(12(23)24-2,15(16,17)18)20-11(22)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,19,21)(H,20,22)
InChIKey
HLRBXLAPLVYEPO-UHFFFAOYSA-N
Synonyms

CC1=CSC(=N1)NC(C(=O)OC)(C(F)(F)F)NC(=O)C2=CC=CC=C2
InChI=1SC15H14F3N3O3Sc1982513(199)2114(12(23)24215(1617)18)2011(22)106435710h38H12H3(H1921)(H2022)
METHYL2(BENZOYLAMINO)333TRIFLUORON(4METHYL13THIAZOL2YL)LALANINATE
METHYL2BENZAMIDO333TRIFLUORO2((4METHYL13THIAZOL2YL)AMINO)PROPANOATE
methyl2benzamido333trifluoro2((4methylthiazol2yl)amino)propanoate
methyl333trifluoro2((4methyl13thiazol2yl)amino)N(phenylcarbonyl)alaninate
MFCD02944965
ZINC000002050287
ZINC000002050288

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.