Vitas-M small molecule compound

(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-6-hydroxy-7-[(3-methylpiperidin-1-yl)methyl]-1-benzofuran-3(2H)-one

Catalog ID
STK992668
SMILES CC1CCCN(C1)Cc1c(O)ccc2c1O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=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 C24H24ClNO5 MW 441.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClNO5/c1-14-3-2-6-26(10-14)11-19-20(27)5-4-18-22(28)21(31-24(18)19)9-15-7-17(25)8-16-12-29-13-30-23(15)16/h4-5,7-9,14,27H,2-3,6,10-13H2,1H3/b21-9-
InChIKey
CQEZUTLYWOFDHN-NKVSQWTQSA-N
Synonyms
929398-06-1
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)6hydroxy7((3methylpiperidin1yl)methyl)1benzofuran3(2H)one
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)6hydroxy7((3methylpiperidin1yl)methyl)1benzofuran3one
(Z)2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)6hydroxy7((3methylpiperidin1yl)methyl)benzofuran3(2H)one
929398061
CC1CCCN(C1)Cc1c(O)ccc2c1OC(=Cc1cc(Cl)cc3c1OCOC3)C2=O
CC1CCCN(C1)CC2=C(C=CC3=C2OC(=CC4=CC(=CC5=C4OCOC5)Cl)C3=O)O
InChI=1SC24H24ClNO5c11432626(1014)111920(27)541822(28)21(3124(18)19)915717(25)8161229133023(15)16h45791427H2361013H21H3b219

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Available files

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