Vitas-M small molecule compound
(4Z)-4-{[3-(4-methoxy-2-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK811795
SMILES COc1ccc(c(c1)C)c1nn(cc1/C=C\1/C(=NN(C1=O)c1ccccc1)C)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 C28H24N4O2 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O2/c1-19-16-24(34-3)14-15-25(19)27-21(18-31(30-27)22-10-6-4-7-11-22)17-26-20(2)29-32(28(26)33)23-12-8-5-9-13-23/h4-18H,1-3H3/b26-17-InChIKey
SQKANABKWGZXNJ-ONUIUJJFSA-NSynonyms
(4Z)4((3(4methoxy2methylphenyl)1phenyl1Hpyrazol4yl)methylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4Z)4((3(4METHOXY2METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
CC1=C(C=CC(=C1)OC)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C)C5=CC=CC=C5
COc1ccc(c(c1)C)c1nn(cc1C=C1C(=NN(C1=O)c1ccccc1)C)c1ccccc1
InChI=1SC28H24N4O2c1191624(343)141525(19)2721(1831(3027)22106471122)172620(2)2932(28(26)33)23128591323h418H13H3b2617
MFCD06264932
ZINC000016713822
ZINC16713822
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