Vitas-M small molecule compound
(4Z)-4-[(3-{4-[(2-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK798283
SMILES O=C1N(N=C(/C/1=C/c1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)c1ccccc1)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 C38H27ClN4O2 MW 607.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H27ClN4O2/c39-35-19-11-10-14-29(35)26-45-33-22-20-28(21-23-33)36-30(25-42(40-36)31-15-6-2-7-16-31)24-34-37(27-12-4-1-5-13-27)41-43(38(34)44)32-17-8-3-9-18-32/h1-25H,26H2/b34-24-InChIKey
MXYHWEHXUWBRHW-BCJTWVECSA-NSynonyms
(4Z)4((3(4((2chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)25diphenyl24dihydro3Hpyrazol3one
(4Z)4((3(4((2CHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)25DIPHENYLPYRAZOL3ONE
C1=CC=C(C=C1)C2=NN(C(=O)C2=CC3=CN(N=C3C4=CC=C(C=C4)OCC5=CC=CC=C5Cl)C6=CC=CC=C6)C7=CC=CC=C7
InChI=1SC38H27ClN4O2c39351911101429(35)264533222028(212333)3630(2542(4036)31156271631)243437(27124151327)4143(38(34)44)32178391832h125H26H2b3424
MFCD03461926
O=C1N(N=C(C1=Cc1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)c1ccccc1)c1ccccc1)c1ccccc1
ZINC000097946160
ZINC97946160
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