Vitas-M small molecule compound

butyl 4-({[4-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)phenyl]carbonyl}amino)benzoate

Catalog ID
STK275658
SMILES CCCCOC(=O)c1ccc(cc1)NC(=O)c1ccc(cc1)N1C(=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 C29H28N2O5 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O5/c1-2-3-14-36-29(35)17-4-8-18(9-5-17)30-26(32)16-6-10-19(11-7-16)31-27(33)24-20-12-13-21(23-15-22(20)23)25(24)28(31)34/h4-13,20-25H,2-3,14-15H2,1H3,(H,30,32)
InChIKey
KQPVFFFDRSQHTA-UHFFFAOYSA-N
Synonyms

butyl4(((4(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)phenyl)carbonyl)amino)benzoate
CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC29H28N2O5c123143629(35)174818(9517)3026(32)1661019(11716)3127(33)2420121321(231522(20)23)25(24)28(31)34h4132025H231415H21H3(H3032)
MFCD03103905
ZINC000239128699
ZINC000239128702

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Available files

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