Vitas-M small molecule compound
(4-{(1E)-2-cyano-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-1-yl}-2-methoxyphenoxy)acetic acid
Catalog ID
STK506455
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCC(=O)O)/C(=O)NCc1ccco1
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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 C18H16N2O6 MW 356.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O6/c1-24-16-8-12(4-5-15(16)26-11-17(21)22)7-13(9-19)18(23)20-10-14-3-2-6-25-14/h2-8H,10-11H2,1H3,(H,20,23)(H,21,22)/b13-7+InChIKey
IBJPYRATEYKJFS-NTUHNPAUSA-NSynonyms
(4((1E)2cyano3((furan2ylmethyl)amino)3oxoprop1en1yl)2methoxyphenoxy)aceticacid
2(4((1E)2CYANO2(N(2FURYLMETHYL)CARBAMOYL)VINYL)2METHOXYPHENOXY)ACETICACID
2(4((E)2CYANO3(FURAN2YLMETHYLAMINO)3OXOPROP1ENYL)2METHOXYPHENOXY)ACETICACID
COC1=C(C=CC(=C1)C=C(C#N)C(=O)NCC2=CC=CO2)OCC(=O)O
InChI=1SC18H16N2O6c12416812(4515(16)261117(21)22)713(919)18(23)2010143262514h28H1011H21H3(H2023)(H2122)b137+
MFCD02940797
ZINC000012419286
ZINC12419286
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