Vitas-M small molecule compound

diethyl 2-(furan-2-yl)-6-methyl-4-[(4-methylphenyl)amino]cyclohexa-3,5-diene-1,3-dicarboxylate

Catalog ID
STK544478
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)C)C=C(C(C1c1ccco1)C(=O)OCC)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 C24H27NO5 MW 409.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO5/c1-5-28-23(26)20-16(4)14-18(25-17-11-9-15(3)10-12-17)21(24(27)29-6-2)22(20)19-8-7-13-30-19/h7-14,20,22,25H,5-6H2,1-4H3
InChIKey
KQEGCJRLMNRRQP-UHFFFAOYSA-N
Synonyms
330217-08-8
330217088
CCOC(=O)C1C(C(=C(C=C1C)NC2=CC=C(C=C2)C)C(=O)OCC)C3=CC=CO3
DIETHYL(1R2R)2(FURAN2YL)6METHYL4((4METHYLPHENYL)AMINO)CYCLOHEXA35DIENE13DICARBOXYLATE
DIETHYL(1R2S)2(FURAN2YL)6METHYL4((4METHYLPHENYL)AMINO)CYCLOHEXA35DIENE13DICARBOXYLATE
DIETHYL(1S2R)2(FURAN2YL)6METHYL4((4METHYLPHENYL)AMINO)CYCLOHEXA35DIENE13DICARBOXYLATE
DIETHYL(1S2S)2(FURAN2YL)6METHYL4((4METHYLPHENYL)AMINO)CYCLOHEXA35DIENE13DICARBOXYLATE
diethyl2(furan2yl)6methyl4((4methylphenyl)amino)cyclohexa35diene13dicarboxylate
DIETHYL2(FURAN2YL)6METHYL4(4METHYLANILINO)CYCLOHEXA35DIENE13DICARBOXYLATE
diethyl2(furan2yl)6methyl4(ptolylamino)cyclohexa35diene13dicarboxylate
DIETHYL2FURAN2YL6METHYL4((4METHYLPHENYL)AMINO)CYCLOHEXA35DIENE13DICARBOXYLATE
InChI=1SC24H27NO5c152823(26)2016(4)1418(251711915(3)101217)21(24(27)2962)22(20)1987133019h714202225H56H214H3
MFCD03293553
ZINC000002359794
ZINC000002359798

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.