Vitas-M small molecule compound
(4Z)-4-{[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK798859
SMILES COc1ccc(cc1C)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/c1-19-16-21(14-15-26(19)34-3)27-22(18-31(30-27)23-10-6-4-7-11-23)17-25-20(2)29-32(28(25)33)24-12-8-5-9-13-24/h4-18H,1-3H3/b25-17-InChIKey
ATOCBSRHJRFOBM-UQQQWYQISA-NSynonyms
(4Z)4((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4Z)4((3(4METHOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C)C5=CC=CC=C5)OC
COc1ccc(cc1C)c1nn(cc1C=C1C(=NN(C1=O)c1ccccc1)C)c1ccccc1
InChI=1SC28H24N4O2c1191621(141526(19)343)2722(1831(3027)23106471123)172520(2)2932(28(25)33)24128591324h418H13H3b2517
MFCD03462104
ZINC000001474247
ZINC01474247
ZINC1474247
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