Vitas-M small molecule compound
{2-ethoxy-4-[(E)-(5-oxo-1-phenyl-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetic acid
Catalog ID
STL378760
SMILES CCCC1=NN(C(=O)/C/1=C/c1ccc(c(c1)OCC)OCC(=O)O)c1ccccc1
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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 C23H24N2O5 MW 408.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O5/c1-3-8-19-18(23(28)25(24-19)17-9-6-5-7-10-17)13-16-11-12-20(30-15-22(26)27)21(14-16)29-4-2/h5-7,9-14H,3-4,8,15H2,1-2H3,(H,26,27)/b18-13+InChIKey
NTKFLDORXPBSPC-QGOAFFKASA-NSynonyms
(2ethoxy4((E)(5oxo1phenyl3propyl15dihydro4Hpyrazol4ylidene)methyl)phenoxy)aceticacid
2(2ETHOXY4((E)(5OXO1PHENYL3PROPYLPYRAZOL4YLIDENE)METHYL)PHENOXY)ACETICACID
CCCC1=NN(C(=O)C1=Cc1ccc(c(c1)OCC)OCC(=O)O)c1ccccc1
CCCC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OCC(=O)O)OCC)C3=CC=CC=C3
InChI=1SC23H24N2O5c1381918(23(28)25(2419)1796571017)1316111220(301522(26)27)21(1416)2942h57914H34815H212H3(H2627)b1813+
MFCD05041322
ZINC000100317144
ZINC100317144
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