Vitas-M small molecule compound

(2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-1-[1-(phenylcarbonyl)piperidin-4-yl]ethanone

Catalog ID
STK589720
SMILES COc1cc2/C(=C/C(=O)C3CCN(CC3)C(=O)c3ccccc3)/NCCc2cc1OC

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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 C25H28N2O4 MW 420.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O4/c1-30-23-14-19-8-11-26-21(20(19)15-24(23)31-2)16-22(28)17-9-12-27(13-10-17)25(29)18-6-4-3-5-7-18/h3-7,14-17,26H,8-13H2,1-2H3/b21-16-
InChIKey
CSCBUELQKROISP-PGMHBOJBSA-N
Synonyms
898918-32-6
(2Z)1(1benzoylpiperidin4yl)2(67dimethoxy34dihydro2Hisoquinolin1ylidene)ethanone
(2Z)2(67dimethoxy34dihydroisoquinolin1(2H)ylidene)1(1(phenylcarbonyl)piperidin4yl)ethanone
(Z)1(1benzoylpiperidin4yl)2(67dimethoxy34dihydroisoquinolin1(2H)ylidene)ethanone
898918326
COC1=C(C=C2C(=C1)CCNC2=CC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4)OC
COc1cc2C(=CC(=O)C3CCN(CC3)C(=O)c3ccccc3)NCCc2cc1OC
InChI=1SC25H28N2O4c1302314198112621(20(19)1524(23)312)1622(28)1791227(131017)25(29)186435718h37141726H813H212H3b2116
MFCD07638930
ZINC000005423362
ZINC05423362
ZINC5423362

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Available files

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