Vitas-M small molecule compound
{4-[(1E)-2-cyano-3-oxo-3-(phenylamino)prop-1-en-1-yl]-2-ethoxyphenoxy}acetic acid
Catalog ID
STK185161
SMILES CCOc1cc(ccc1OCC(=O)O)/C=C(/C(=O)Nc1ccccc1)\C#N
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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 C20H18N2O5 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5/c1-2-26-18-11-14(8-9-17(18)27-13-19(23)24)10-15(12-21)20(25)22-16-6-4-3-5-7-16/h3-11H,2,13H2,1H3,(H,22,25)(H,23,24)/b15-10+InChIKey
QRGCKRICTVNWBU-XNTDXEJSSA-NSynonyms
357961-34-3(4((1E)2CYANO3OXO3(PHENYLAMINO)PROP1EN1YL)2ETHOXYPHENOXY)ACETICACID
2(4((E)3ANILINO2CYANO3OXOPROP1ENYL)2ETHOXYPHENOXY)ACETICACID
357961343
CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2)OCC(=O)O
CCOc1cc(ccc1OCC(=O)O)C=C(C(=O)Nc1ccccc1)C#N
InChI=1SC20H18N2O5c1226181114(8917(18)271319(23)24)1015(1221)20(25)22166435716h311H213H21H3(H2225)(H2324)b1510+
MFCD03226471
ZINC000002774499
ZINC2774499
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