Vitas-M small molecule compound
{2-[(E)-(5-oxo-1-phenyl-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetic acid
Catalog ID
STL378757
SMILES CCCC1=NN(C(=O)/C/1=C/c1ccccc1OCC(=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 C21H20N2O4 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O4/c1-2-8-18-17(21(26)23(22-18)16-10-4-3-5-11-16)13-15-9-6-7-12-19(15)27-14-20(24)25/h3-7,9-13H,2,8,14H2,1H3,(H,24,25)/b17-13+InChIKey
DJFOZOULCBVXPX-GHRIWEEISA-NSynonyms
(2((E)(5oxo1phenyl3propyl15dihydro4Hpyrazol4ylidene)methyl)phenoxy)aceticacid
2(2((E)(5OXO1PHENYL3PROPYLPYRAZOL4YLIDENE)METHYL)PHENOXY)ACETICACID
CCCC1=NN(C(=O)C1=Cc1ccccc1OCC(=O)O)c1ccccc1
CCCC1=NN(C(=O)C1=CC2=CC=CC=C2OCC(=O)O)C3=CC=CC=C3
InChI=1SC21H20N2O4c1281817(21(26)23(2218)16104351116)13159671219(15)271420(24)25h37913H2814H21H3(H2425)b1713+
MFCD05041317
ZINC000100316677
ZINC100316677
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