Vitas-M small molecule compound
(4E)-4-[3-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK385552
SMILES COc1cc(ccc1OCc1cccc2c1cccc2)/C=C/1\C(=NN(C1=O)c1ccccc1)C
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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 C29H24N2O3 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N2O3/c1-20-26(29(32)31(30-20)24-12-4-3-5-13-24)17-21-15-16-27(28(18-21)33-2)34-19-23-11-8-10-22-9-6-7-14-25(22)23/h3-18H,19H2,1-2H3/b26-17+InChIKey
QEBKDCZSXXIRCS-YZSQISJMSA-NSynonyms
(4E)4((3METHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(4E)4(3METHOXY4(NAPHTHALEN1YLMETHOXY)BENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OCC3=CC=CC4=CC=CC=C43)OC)C5=CC=CC=C5
COc1cc(ccc1OCc1cccc2c1cccc2)C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC29H24N2O3c12026(29(32)31(3020)24124351324)1721151627(28(1821)332)34192311810229671425(22)23h318H19H212H3b2617+
MFCD02120993
ZINC000100313407
ZINC100313407
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