Vitas-M small molecule compound

(3Z)-5-bromo-3-(2-chloro-4,5-dimethoxybenzylidene)-1,3-dihydro-2H-indol-2-one

Catalog ID
STK521261
SMILES COc1cc(/C=C/2\C(=O)Nc3c2cc(Br)cc3)c(cc1OC)Cl

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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 C17H13BrClNO3 MW 394.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrClNO3/c1-22-15-6-9(13(19)8-16(15)23-2)5-12-11-7-10(18)3-4-14(11)20-17(12)21/h3-8H,1-2H3,(H,20,21)/b12-5-
InChIKey
LPLJLUFJAJDZFM-XGICHPGQSA-N
Synonyms

(3Z)5BROMO3((2CHLORO45DIMETHOXYPHENYL)METHYLIDENE)1HINDOL2ONE
(3Z)5bromo3(2chloro45dimethoxybenzylidene)13dihydro2Hindol2one
COC1=C(C=C(C(=C1)C=C2C3=C(C=CC(=C3)Br)NC2=O)Cl)OC
COc1cc(C=C2C(=O)Nc3c2cc(Br)cc3)c(cc1OC)Cl
InChI=1SC17H13BrClNO3c1221569(13(19)816(15)232)51211710(18)3414(11)2017(12)21h38H12H3(H2021)b125
MFCD03080405
ZINC000015016149
ZINC15016149

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Available files

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