Vitas-M small molecule compound

(4E)-5-(3-bromophenyl)-4-{hydroxy[2-methyl-4-(2-methylpropoxy)phenyl]methylidene}-1-(2-methoxyethyl)pyrrolidine-2,3-dione

Catalog ID
STK628716
SMILES COCCN1C(c2cccc(c2)Br)/C(=C(/c2ccc(cc2C)OCC(C)C)\O)/C(=O)C1=O

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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 C25H28BrNO5 MW 502.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28BrNO5/c1-15(2)14-32-19-8-9-20(16(3)12-19)23(28)21-22(17-6-5-7-18(26)13-17)27(10-11-31-4)25(30)24(21)29/h5-9,12-13,15,22,28H,10-11,14H2,1-4H3/b23-21+
InChIKey
OVSKMWDZMWLNEC-XTQSDGFTSA-N
Synonyms
488812-29-9
(4E)5(3bromophenyl)4(hydroxy(2methyl4(2methylpropoxy)phenyl)methylidene)1(2methoxyethyl)pyrrolidine23dione
488812299
CC1=C(C=CC(=C1)OCC(C)C)C(=C2C(N(C(=O)C2=O)CCOC)C3=CC(=CC=C3)Br)O
COCCN1C(c2cccc(c2)Br)C(=C(c2ccc(cc2C)OCC(C)C)O)C(=O)C1=O
InChI=1SC25H28BrNO5c115(2)1432198920(16(3)1219)23(28)2122(1765718(26)1317)27(1011314)25(30)24(21)29h591213152228H101114H214H3b2321+
MFCD09795820
ZINC000102732067
ZINC000102732071

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Available files

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