Vitas-M small molecule compound

(2Z)-2-(3,4-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl diethylcarbamate

Catalog ID
STK626098
SMILES CCN(C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(c(c1)Cl)Cl)/C2=O)CC

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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 C20H17Cl2NO4 MW 406.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2NO4/c1-3-23(4-2)20(25)26-13-6-7-14-17(11-13)27-18(19(14)24)10-12-5-8-15(21)16(22)9-12/h5-11H,3-4H2,1-2H3/b18-10-
InChIKey
XCYHPCPNMIYTMJ-ZDLGFXPLSA-N
Synonyms
622797-22-2
((2Z)2((34DICHLOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)NNDIETHYLCARBAMATE
(2((34DICHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)NNDIETHYLCARBOXAMIDE
(2Z)2(34dichlorobenzylidene)3oxo23dihydro1benzofuran6yldiethylcarbamate
(Z)2(34dichlorobenzylidene)3oxo23dihydrobenzofuran6yldiethylcarbamate
622797222
CCN(C(=O)Oc1ccc2c(c1)OC(=Cc1ccc(c(c1)Cl)Cl)C2=O)CC
CCN(CC)C(=O)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=C(C=C3)Cl)Cl)O2
InChI=1SC20H17Cl2NO4c1323(42)20(25)2613671417(1113)2718(19(14)24)10125815(21)16(22)912h511H34H212H3b1810
MFCD04180240
ZINC000005894602
ZINC05894602
ZINC5894602

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Available files

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