Vitas-M small molecule compound
(4E)-4-[4-ethoxy-2-methyl-5-(propan-2-yl)benzylidene]-2-phenyl-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK112286
SMILES CCCC1=NN(C(=O)/C/1=C/c1cc(C(C)C)c(cc1C)OCC)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 C25H30N2O2 MW 390.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O2/c1-6-11-23-22(25(28)27(26-23)20-12-9-8-10-13-20)16-19-15-21(17(3)4)24(29-7-2)14-18(19)5/h8-10,12-17H,6-7,11H2,1-5H3/b22-16+InChIKey
BQLAIFJLTOUHPE-CJLVFECKSA-NSynonyms
(4E)4((4ETHOXY2METHYL5PROPAN2YLPHENYL)METHYLIDENE)2PHENYL5PROPYLPYRAZOL3ONE
(4E)4(4ETHOXY2METHYL5(PROPAN2YL)BENZYLIDENE)2PHENYL5PROPYL24DIHYDRO3HPYRAZOL3ONE
CCCC1=NN(C(=O)C1=Cc1cc(C(C)C)c(cc1C)OCC)c1ccccc1
CCCC1=NN(C(=O)C1=CC2=CC(=C(C=C2C)OCC)C(C)C)C3=CC=CC=C3
InChI=1SC25H30N2O2c16112322(25(28)27(2623)201298101320)16191521(17(3)4)24(2972)1418(19)5h8101217H6711H215H3b2216+
MFCD04127195
ZINC000100317546
ZINC100317546
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