Vitas-M small molecule compound

methyl 3,3,3-trifluoro-2-phenoxy-N-[(2-phenylethyl)carbamoyl]alaninate

Catalog ID
STK792161
SMILES COC(=O)C(C(F)(F)F)(Oc1ccccc1)NC(=O)NCCc1ccccc1

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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 C19H19F3N2O4 MW 396.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19F3N2O4/c1-27-16(25)18(19(20,21)22,28-15-10-6-3-7-11-15)24-17(26)23-13-12-14-8-4-2-5-9-14/h2-11H,12-13H2,1H3,(H2,23,24,26)
InChIKey
ZCSRDJSGBDNZOM-UHFFFAOYSA-N
Synonyms

COC(=O)C(C(F)(F)F)(NC(=O)NCCC1=CC=CC=C1)OC2=CC=CC=C2
InChI=1SC19H19F3N2O4c12716(25)18(19(2021)222815106371115)2417(26)231312148425914h211H1213H21H3(H2232426)
METHYL333TRIFLUORO2(PHENETHYLCARBAMOYLAMINO)2PHENOXYPROPANOATE
methyl333trifluoro2phenoxy2(2phenylethylcarbamoylamino)propanoate
methyl333trifluoro2phenoxyN((2phenylethyl)carbamoyl)alaninate
MFCD05257272
ZINC000004686441
ZINC000004686443

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Available files

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