Vitas-M small molecule compound

N-(3-acetylphenyl)-6-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)hexanamide

Catalog ID
STK253380
SMILES O=C(Nc1cccc(c1)C(=O)C)CCCCCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2

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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 C25H28N2O4 MW 420.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O4/c1-14(28)15-6-5-7-16(12-15)26-21(29)8-3-2-4-11-27-24(30)22-17-9-10-18(20-13-19(17)20)23(22)25(27)31/h5-7,9-10,12,17-20,22-23H,2-4,8,11,13H2,1H3,(H,26,29)
InChIKey
AQIZKCBRIYLJCU-UHFFFAOYSA-N
Synonyms

CC(=O)C1=CC(=CC=C1)NC(=O)CCCCCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC25H28N2O4c114(28)1565716(1215)2621(29)8324112724(30)221791018(201319(17)20)23(22)25(27)31h579101217202223H2481113H21H3(H2629)
MFCD03835741
N(3acetylphenyl)6(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)hexanamide
ZINC000239274742
ZINC000239274745

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Available files

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