Vitas-M small molecule compound
5-{(1E)-2-cyano-3-[(2-fluorophenyl)amino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl naphthalene-1-carboxylate
Catalog ID
STK522765
SMILES N#C/C(=C\c1ccc(c(c1)OC(=O)c1cccc2c1cccc2)OC)/C(=O)Nc1ccccc1F
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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 C28H19FN2O4 MW 466.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H19FN2O4/c1-34-25-14-13-18(15-20(17-30)27(32)31-24-12-5-4-11-23(24)29)16-26(25)35-28(33)22-10-6-8-19-7-2-3-9-21(19)22/h2-16H,1H3,(H,31,32)/b20-15+InChIKey
VHFAJFFKPPDMLK-HMMYKYKNSA-NSynonyms
(5((E)2CYANO3(2FLUOROANILINO)3OXOPROP1ENYL)2METHOXYPHENYL)NAPHTHALENE1CARBOXYLATE
5((1E)2cyano3((2fluorophenyl)amino)3oxoprop1en1yl)2methoxyphenylnaphthalene1carboxylate
COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC=C2F)OC(=O)C3=CC=CC4=CC=CC=C43
InChI=1SC28H19FN2O4c13425141318(1520(1730)27(32)312412541123(24)29)1626(25)3528(33)22106819723921(19)22h216H1H3(H3132)b2015+
MFCD03158042
N#CC(=Cc1ccc(c(c1)OC(=O)c1cccc2c1cccc2)OC)C(=O)Nc1ccccc1F
ZINC000012590198
ZINC12590198
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