Vitas-M small molecule compound
(4Z)-4-[(3-{4-[(2-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-5-{[(4-chlorophenyl)sulfanyl]methyl}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK799243
SMILES Clc1ccc(cc1)SCC1=NN(C(=O)/C/1=C\c1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)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 C39H28Cl2N4O2S MW 687.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H28Cl2N4O2S/c40-30-17-21-34(22-18-30)48-26-37-35(39(46)45(42-37)32-12-5-2-6-13-32)23-29-24-44(31-10-3-1-4-11-31)43-38(29)27-15-19-33(20-16-27)47-25-28-9-7-8-14-36(28)41/h1-24H,25-26H2/b35-23-InChIKey
UAEFEMCHJHHTPV-NHYZDEDTSA-NSynonyms
(4Z)4((3(4((2chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)5(((4chlorophenyl)sulfanyl)methyl)2phenyl24dihydro3Hpyrazol3one
(4Z)4((3(4((2CHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)5((4CHLOROPHENYL)SULFANYLMETHYL)2PHENYLPYRAZOL3ONE
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4Cl)C=C5C(=NN(C5=O)C6=CC=CC=C6)CSC7=CC=C(C=C7)Cl
Clc1ccc(cc1)SCC1=NN(C(=O)C1=Cc1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)c1ccccc1)c1ccccc1
InChI=1SC39H28Cl2N4O2Sc4030172134(221830)48263735(39(46)45(4237)32125261332)23292444(31103141131)4338(29)27151933(201627)4725289781436(28)41h124H2526H2b3523
MFCD03462343
ZINC000150398959
ZINC150398959
Check stock
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Check stock on Vitas-MAvailable files
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