Vitas-M small molecule compound
(4Z)-4-{[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK822752
SMILES CCOc1ccc(cc1C)c1nn(cc1/C=C\1/C(=NN(C1=O)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 C34H28N4O2 MW 524.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28N4O2/c1-3-40-31-20-19-26(21-24(31)2)32-27(23-37(35-32)28-15-9-5-10-16-28)22-30-33(25-13-7-4-8-14-25)36-38(34(30)39)29-17-11-6-12-18-29/h4-23H,3H2,1-2H3/b30-22-InChIKey
LRKWKYLPEZVLMW-SWKFRHMKSA-NSynonyms
(4Z)4((3(4ethoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)25diphenyl24dihydro3Hpyrazol3one
(4Z)4((3(4ethoxy3methylphenyl)1phenylpyrazol4yl)methylidene)25diphenylpyrazol3one
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C
CCOc1ccc(cc1C)c1nn(cc1C=C1C(=NN(C1=O)c1ccccc1)c1ccccc1)c1ccccc1
InChI=1SC34H28N4O2c134031201926(2124(31)2)3227(2337(3532)281595101628)223033(25137481425)3638(34(30)39)2917116121829h423H3H212H3b3022
MFCD03212376
ZINC000027017274
ZINC27017274
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