Vitas-M small molecule compound

4-chloro-1-(4-fluorophenyl)-1-oxobutan-2-yl 1-benzyl-5-oxopyrrolidine-3-carboxylate

Catalog ID
STK290321
SMILES ClCCC(C(=O)c1ccc(cc1)F)OC(=O)C1CC(=O)N(C1)Cc1ccccc1

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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 C22H21ClFNO4 MW 417.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClFNO4/c23-11-10-19(21(27)16-6-8-18(24)9-7-16)29-22(28)17-12-20(26)25(14-17)13-15-4-2-1-3-5-15/h1-9,17,19H,10-14H2
InChIKey
MCTUSAOKJRXFPH-UHFFFAOYSA-N
Synonyms

(4chloro1(4fluorophenyl)1oxobutan2yl)1benzyl5oxopyrrolidine3carboxylate
4chloro1(4fluorophenyl)1oxobutan2yl1benzyl5oxopyrrolidine3carboxylate
C1C(CN(C1=O)CC2=CC=CC=C2)C(=O)OC(CCCl)C(=O)C3=CC=C(C=C3)F
InChI=1SC22H21ClFNO4c23111019(21(27)166818(24)9716)2922(28)171220(26)25(1417)13154213515h191719H1014H2
MFCD06128115
ZINC000009590792
ZINC000009590806

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Available files

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