Vitas-M small molecule compound
(4Z)-4-{[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-5-(4-methoxyphenyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK822956
SMILES COc1ccc(cc1)C1=NN(C(=O)/C/1=C\c1cn(nc1c1ccc(cc1)Br)c1ccccc1)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 C32H23BrN4O2 MW 575.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23BrN4O2/c1-39-28-18-14-23(15-19-28)31-29(32(38)37(35-31)27-10-6-3-7-11-27)20-24-21-36(26-8-4-2-5-9-26)34-30(24)22-12-16-25(33)17-13-22/h2-21H,1H3/b29-20-InChIKey
TUJGOEITFDSHAI-BRPDVVIDSA-NSynonyms
(4Z)4((3(4bromophenyl)1phenyl1Hpyrazol4yl)methylidene)5(4methoxyphenyl)2phenyl24dihydro3Hpyrazol3one
(4Z)4((3(4bromophenyl)1phenylpyrazol4yl)methylidene)5(4methoxyphenyl)2phenylpyrazol3one
COC1=CC=C(C=C1)C2=NN(C(=O)C2=CC3=CN(N=C3C4=CC=C(C=C4)Br)C5=CC=CC=C5)C6=CC=CC=C6
COc1ccc(cc1)C1=NN(C(=O)C1=Cc1cn(nc1c1ccc(cc1)Br)c1ccccc1)c1ccccc1
InChI=1SC32H23BrN4O2c13928181423(151928)3129(32(38)37(3531)27106371127)20242136(268425926)3430(24)22121625(33)171322h221H1H3b2920
MFCD03463515
ZINC000097947114
ZINC97947114
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