Vitas-M small molecule compound
(2-bromo-4-{(1E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxoprop-1-en-1-yl}phenoxy)acetic acid
Catalog ID
STK180944
SMILES N#C/C(=C\c1ccc(c(c1)Br)OCC(=O)O)/C(=O)Nc1ccc(cc1)OC
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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 C19H15BrN2O5 MW 431.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15BrN2O5/c1-26-15-5-3-14(4-6-15)22-19(25)13(10-21)8-12-2-7-17(16(20)9-12)27-11-18(23)24/h2-9H,11H2,1H3,(H,22,25)(H,23,24)/b13-8+InChIKey
LLAXCFPNRPUVFG-MDWZMJQESA-NSynonyms
357963-64-5(2BROMO4((1E)2CYANO3((4METHOXYPHENYL)AMINO)3OXOPROP1EN1YL)PHENOXY)ACETICACID
2(2BROMO4((E)2CYANO3(4METHOXYANILINO)3OXOPROP1ENYL)PHENOXY)ACETICACID
357963645
COC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC(=O)O)Br)C#N
InChI=1SC19H15BrN2O5c126155314(4615)2219(25)13(1021)8122717(16(20)912)271118(23)24h29H11H21H3(H2225)(H2324)b138+
MFCD02611947
N#CC(=Cc1ccc(c(c1)Br)OCC(=O)O)C(=O)Nc1ccc(cc1)OC
ZINC000009311558
ZINC9311558
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