Vitas-M small molecule compound

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

Catalog ID
STK275666
SMILES O=C(C(N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)Cc1ccccc1)Nc1ccc(cc1)C(=O)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 C28H26N2O4 MW 454.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O4/c1-15(31)17-7-9-18(10-8-17)29-26(32)23(13-16-5-3-2-4-6-16)30-27(33)24-19-11-12-20(22-14-21(19)22)25(24)28(30)34/h2-12,19-25H,13-14H2,1H3,(H,29,32)
InChIKey
KNJJNPRPAWECJH-UHFFFAOYSA-N
Synonyms

CC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC28H26N2O4c115(31)177918(10817)2926(32)23(13165324616)3027(33)2419111220(221421(19)22)25(24)28(30)34h2121925H1314H21H3(H2932)
MFCD03103943
N(4acetylphenyl)2(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)3phenylpropanamide
ZINC000239331369
ZINC000239331372

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Available files

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