Vitas-M small molecule compound

(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-6-[(2-methylbenzyl)oxy]-1-benzofuran-3(2H)-one

Catalog ID
STK620360
SMILES Clc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OCc2ccccc2C)c2c(c1)COCO2

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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 C25H19ClO5 MW 434.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClO5/c1-15-4-2-3-5-16(15)13-29-20-6-7-21-22(11-20)31-23(24(21)27)10-17-8-19(26)9-18-12-28-14-30-25(17)18/h2-11H,12-14H2,1H3/b23-10-
InChIKey
UAFIWGJHPLSYQU-RMORIDSASA-N
Synonyms
929489-50-9
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)6((2methylbenzyl)oxy)1benzofuran3(2H)one
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)6((2methylphenyl)methoxy)1benzofuran3one
(Z)2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)6((2methylbenzyl)oxy)benzofuran3(2H)one
2((6CHLORO(2H4HBENZO(E)13DIOXIN8YL))METHYLENE)6((2METHYLPHENYL)METHOXY)BENZO(B)FURAN3ONE
929489509
CC1=CC=CC=C1COC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC5=C4OCOC5)Cl)O3
Clc1cc(C=C2Oc3c(C2=O)ccc(c3)OCc2ccccc2C)c2c(c1)COCO2
InChI=1SC25H19ClO5c115423516(15)132920672122(1120)3123(24(21)27)1017819(26)9181228143025(17)18h211H1214H21H3b2310
MFCD09793531
ZINC000009476703
ZINC09476703
ZINC9476703

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Available files

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