Vitas-M small molecule compound

methyl N-{[1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]carbonyl}phenylalaninate

Catalog ID
STK719045
SMILES COC(=O)C(Cc1ccccc1)NC(=O)C1CC(=O)N(C1)c1ccc(cc1)Cl

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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 C21H21ClN2O4 MW 400.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O4/c1-28-21(27)18(11-14-5-3-2-4-6-14)23-20(26)15-12-19(25)24(13-15)17-9-7-16(22)8-10-17/h2-10,15,18H,11-13H2,1H3,(H,23,26)
InChIKey
ICCCCLUZADHLSX-UHFFFAOYSA-N
Synonyms

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Cl
InChI=1SC21H21ClN2O4c12821(27)18(11145324614)2320(26)151219(25)24(1315)179716(22)81017h2101518H1113H21H3(H2326)
methyl2((1(4chlorophenyl)5oxopyrrolidine3carbonyl)amino)3phenylpropanoate
methyl2(1(4chlorophenyl)5oxopyrrolidine3carboxamido)3phenylpropanoate
methylN((1(4chlorophenyl)5oxopyrrolidin3yl)carbonyl)phenylalaninate
MFCD12205328
ZINC000020715103
ZINC000020715116

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Available files

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