Vitas-M small molecule compound

(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(morpholin-4-yl)propyl]-5-(3-propoxyphenyl)pyrrolidine-2,3-dione

Catalog ID
STK613024
SMILES CCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCCN1CCOCC1

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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 C29H34N2O7 MW 522.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O7/c1-2-13-36-22-6-3-5-20(18-22)26-25(27(32)21-7-8-23-24(19-21)38-17-16-37-23)28(33)29(34)31(26)10-4-9-30-11-14-35-15-12-30/h3,5-8,18-19,26,32H,2,4,9-17H2,1H3/b27-25+
InChIKey
QBDXIVUUHTXYBQ-IMVLJIQESA-N
Synonyms
618409-24-8
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(3(morpholin4yl)propyl)5(3propoxyphenyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)5(3PROPOXYPHENYL)PYRROLIDINE23DIONE
(E)23DIHYDRO14BENZODIOXIN6YL(1(3MORPHOLIN4IUM4YLPROPYL)45DIOXO2(3PROPOXYPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
CCCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCCN5CCOCC5
CCCOc1cccc(c1)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1CCCN1CCOCC1
InChI=1SC29H34N2O7c1213362263520(1822)2625(27(32)21782324(1921)3817163723)28(33)29(34)31(26)104930111435151230h35818192632H24917H21H3b2725+
MFCD08735717
ZINC000102710669
ZINC000102710670

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Available files

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