Vitas-M small molecule compound
(4-{(1E)-3-[(3-bromophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-2,6-dichlorophenoxy)acetic acid
Catalog ID
STK180953
SMILES N#C/C(=C\c1cc(Cl)c(c(c1)Cl)OCC(=O)O)/C(=O)Nc1cccc(c1)Br
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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 C18H11BrCl2N2O4 MW 470.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11BrCl2N2O4/c19-12-2-1-3-13(7-12)23-18(26)11(8-22)4-10-5-14(20)17(15(21)6-10)27-9-16(24)25/h1-7H,9H2,(H,23,26)(H,24,25)/b11-4+InChIKey
GKXFJMGFBMRRPM-NYYWCZLTSA-NSynonyms
(4((1E)3((3BROMOPHENYL)AMINO)2CYANO3OXOPROP1EN1YL)26DICHLOROPHENOXY)ACETICACID
2(4((E)3(3BROMOANILINO)2CYANO3OXOPROP1ENYL)26DICHLOROPHENOXY)ACETICACID
C1=CC(=CC(=C1)Br)NC(=O)C(=CC2=CC(=C(C(=C2)Cl)OCC(=O)O)Cl)C#N
InChI=1SC18H11BrCl2N2O4c191221313(712)2318(26)11(822)410514(20)17(15(21)610)27916(24)25h17H9H2(H2326)(H2425)b114+
MFCD04535424
N#CC(=Cc1cc(Cl)c(c(c1)Cl)OCC(=O)O)C(=O)Nc1cccc(c1)Br
ZINC000015012678
ZINC15012678
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