Vitas-M small molecule compound
(4E)-4-[(2E)-3-(2-methoxyphenyl)-1-(4-methylphenyl)prop-2-en-1-ylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL477722
SMILES COc1ccccc1/C=C/C(=C\1/C(=NN(C1=O)c1ccccc1)C)/c1ccc(cc1)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 C27H24N2O2 MW 408.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O2/c1-19-13-15-21(16-14-19)24(18-17-22-9-7-8-12-25(22)31-3)26-20(2)28-29(27(26)30)23-10-5-4-6-11-23/h4-18H,1-3H3/b18-17+,26-24+InChIKey
IVZDVNROUSBGJQ-FAWJACLCSA-NSynonyms
331862-05-6(4E)4((2E)3(2methoxyphenyl)1(4methylphenyl)prop2en1ylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4E)4((E)3(2METHOXYPHENYL)1(4METHYLPHENYL)PROP2ENYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
331862056
CC1=CC=C(C=C1)C(=C2C(=NN(C2=O)C3=CC=CC=C3)C)C=CC4=CC=CC=C4OC
COc1ccccc1C=CC(=C1C(=NN(C1=O)c1ccccc1)C)c1ccc(cc1)C
InChI=1SC27H24N2O2c119131521(161419)24(1817229781225(22)313)2620(2)2829(27(26)30)23105461123h418H13H3b1817+2624+
MFCD03192670
ZINC000004476921
ZINC4476921
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