Vitas-M small molecule compound

methyl 2-({[1-(4-tert-butylphenyl)-5-oxopyrrolidin-3-yl]carbonyl}amino)benzoate

Catalog ID
STK727216
SMILES COC(=O)c1ccccc1NC(=O)C1CC(=O)N(C1)c1ccc(cc1)C(C)(C)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 C23H26N2O4 MW 394.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O4/c1-23(2,3)16-9-11-17(12-10-16)25-14-15(13-20(25)26)21(27)24-19-8-6-5-7-18(19)22(28)29-4/h5-12,15H,13-14H2,1-4H3,(H,24,27)
InChIKey
NIFZQVURWYHECC-UHFFFAOYSA-N
Synonyms

CC(C)(C)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC23H26N2O4c123(23)1691117(121016)251415(1320(25)26)21(27)2419865718(19)22(28)294h51215H1314H214H3(H2427)
methyl2(((1(4tertbutylphenyl)5oxopyrrolidin3yl)carbonyl)amino)benzoate
METHYL2((1(4TERTBUTYLPHENYL)5OXOPYRROLIDINE3CARBONYL)AMINO)BENZOATE
MFCD02647922
ZINC000000709966
ZINC000000709967

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Available files

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