Vitas-M small molecule compound

2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-N-(2-methoxyphenyl)-3-phenylpropanamide

Catalog ID
STK258001
SMILES COc1ccccc1NC(=O)C(N1C(=O)C2C(C1=O)C1CC2C=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 C25H24N2O4 MW 416.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O4/c1-31-20-10-6-5-9-18(20)26-23(28)19(13-15-7-3-2-4-8-15)27-24(29)21-16-11-12-17(14-16)22(21)25(27)30/h2-12,16-17,19,21-22H,13-14H2,1H3,(H,26,28)
InChIKey
LSTRSQANUKKRIC-UHFFFAOYSA-N
Synonyms

2(13DIOXO133A477AHEXAHYDRO2H47METHANOISOINDOL2YL)N(2METHOXYPHENYL)3PHENYLPROPANAMIDE
COC1=CC=CC=C1NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4C5CC(C4C3=O)C=C5
InChI=1SC25H24N2O4c131201065918(20)2623(28)19(13157324815)2724(29)2116111217(1416)22(21)25(27)30h2121617192122H1314H21H3(H2628)
MFCD03104019
ZINC000100281545
ZINC000238901374

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Available files

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