Vitas-M small molecule compound

4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-methylphenyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate

Catalog ID
STK264796
SMILES O=C(C1CC(=O)N(C1)c1ccc(cc1)C)Oc1ccc(c(c1)C)N1C(=O)C2C(C1=O)C1CC2C=C1

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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 C28H26N2O5 MW 470.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O5/c1-15-3-7-20(8-4-15)29-14-19(13-23(29)31)28(34)35-21-9-10-22(16(2)11-21)30-26(32)24-17-5-6-18(12-17)25(24)27(30)33/h3-11,17-19,24-25H,12-14H2,1-2H3
InChIKey
VYJVABATGHLSAZ-UHFFFAOYSA-N
Synonyms

4(13dioxo133a477ahexahydro2H47methanoisoindol2yl)3methylphenyl1(4methylphenyl)5oxopyrrolidine3carboxylate
CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC(=C(C=C3)N4C(=O)C5C6CC(C5C4=O)C=C6)C
InChI=1SC28H26N2O5c1153720(8415)291419(1323(29)31)28(34)352191022(16(2)1121)3026(32)24175618(1217)25(24)27(30)33h31117192425H1214H212H3
MFCD06194740
ZINC000100398714
ZINC000239235428

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Available files

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