Vitas-M small molecule compound

(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[4-(dimethylamino)phenyl]-1-(2-phenylethyl)pyrrolidine-2,3-dione

Catalog ID
STK568911
SMILES O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1CCc1ccccc1)c1ccc(cc1)N(C)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 C29H28N2O5 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O5/c1-30(2)22-11-8-20(9-12-22)26-25(27(32)21-10-13-23-24(18-21)36-17-16-35-23)28(33)29(34)31(26)15-14-19-6-4-3-5-7-19/h3-13,18,26,32H,14-17H2,1-2H3/b27-25+
InChIKey
HHWMWPPBQUPDAA-IMVLJIQESA-N
Synonyms
618856-11-4
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(4(dimethylamino)phenyl)1(2phenylethyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(4DIMETHYLAMINOPHENYL)1PHENETHYLPYRROLIDINE23DIONE
618856114
CN(C)C1=CC=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCC5=CC=CC=C5
InChI=1SC29H28N2O5c130(2)2211820(91222)2625(27(32)2110132324(1821)3617163523)28(33)29(34)31(26)1514196435719h313182632H1417H212H3b2725+
MFCD05728581
O=C1C(=O)C(=C(c2ccc3c(c2)OCCO3)O)C(N1CCc1ccccc1)c1ccc(cc1)N(C)C
ZINC000102554901
ZINC000102554912

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Available files

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