Vitas-M small molecule compound

2-[(4-fluorophenyl)amino]-2-oxoethyl 2-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)-3-phenylpropanoate

Catalog ID
STK265873
SMILES O=C(Nc1ccc(cc1)F)COC(=O)C(N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)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 C28H25FN2O5 MW 488.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25FN2O5/c29-16-6-8-17(9-7-16)30-23(32)14-36-28(35)22(12-15-4-2-1-3-5-15)31-26(33)24-18-10-11-19(21-13-20(18)21)25(24)27(31)34/h1-11,18-22,24-25H,12-14H2,(H,30,32)
InChIKey
AYRFEZHRCJJRFE-UHFFFAOYSA-N
Synonyms

2((4fluorophenyl)amino)2oxoethyl2(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)3phenylpropanoate
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)C(CC5=CC=CC=C5)C(=O)OCC(=O)NC6=CC=C(C=C6)F
InChI=1SC28H25FN2O5c29166817(9716)3023(32)143628(35)22(12154213515)3126(33)2418101119(211320(18)21)25(24)27(31)34h11118222425H1214H2(H3032)
MFCD06756355
ZINC000239274931
ZINC000239274934

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Available files

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