Vitas-M small molecule compound

methyl 3,3,3-trifluoro-N-(phenylcarbonyl)-2-(1,3-thiazol-2-ylamino)alaninate

Catalog ID
STK535762
SMILES COC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)Nc1nccs1

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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 C14H12F3N3O3S MW 359.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12F3N3O3S/c1-23-11(22)13(14(15,16)17,20-12-18-7-8-24-12)19-10(21)9-5-3-2-4-6-9/h2-8H,1H3,(H,18,20)(H,19,21)
InChIKey
PMFFOAKEJDQVMG-UHFFFAOYSA-N
Synonyms

COC(=O)C(C(F)(F)F)(NC1=NC=CS1)NC(=O)C2=CC=CC=C2
InChI=1SC14H12F3N3O3Sc12311(22)13(14(1516)17201218782412)1910(21)9532469h28H1H3(H1820)(H1921)
METHYL2BENZAMIDO333TRIFLUORO2(13THIAZOL2YLAMINO)PROPANOATE
methyl2benzamido333trifluoro2(thiazol2ylamino)propanoate
methyl333trifluoroN(phenylcarbonyl)2(13thiazol2ylamino)alaninate
METHYLNBENZOYL333TRIFLUORO2(13THIAZOL2YLAMINO)DALANINATE
METHYLNBENZOYL333TRIFLUORO2(13THIAZOL2YLAMINO)LALANINATE
MFCD02934180
ZINC000002305271
ZINC000002305272

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Available files

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