Vitas-M small molecule compound

(2Z)-2-(3,4-dichlorobenzylidene)-6-hydroxy-7-(pyrrolidin-1-ylmethyl)-1-benzofuran-3(2H)-one

Catalog ID
STK992611
SMILES O=C1/C(=C/c2ccc(c(c2)Cl)Cl)/Oc2c1ccc(c2CN1CCCC1)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 C20H17Cl2NO3 MW 390.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2NO3/c21-15-5-3-12(9-16(15)22)10-18-19(25)13-4-6-17(24)14(20(13)26-18)11-23-7-1-2-8-23/h3-6,9-10,24H,1-2,7-8,11H2/b18-10-
InChIKey
NKYKTRQXWHAMAZ-ZDLGFXPLSA-N
Synonyms
929397-80-8
(2Z)2((34dichlorophenyl)methylidene)6hydroxy7(pyrrolidin1ylmethyl)1benzofuran3one
(2Z)2(34dichlorobenzylidene)6hydroxy7(pyrrolidin1ylmethyl)1benzofuran3(2H)one
(Z)2(34dichlorobenzylidene)6hydroxy7(pyrrolidin1ylmethyl)benzofuran3(2H)one
929397808
C1CCN(C1)CC2=C(C=CC3=C2OC(=CC4=CC(=C(C=C4)Cl)Cl)C3=O)O
InChI=1SC20H17Cl2NO3c21155312(916(15)22)101819(25)134617(24)14(20(13)2618)1123712823h3691024H127811H2b1810
O=C1C(=Cc2ccc(c(c2)Cl)Cl)Oc2c1ccc(c2CN1CCCC1)O

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Available files

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