Vitas-M small molecule compound
(4Z)-4-[(3-{4-[(4-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK797850
SMILES Clc1ccc(cc1)COc1ccc(cc1)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 C33H25ClN4O2 MW 545.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H25ClN4O2/c1-23-31(33(39)38(35-23)29-10-6-3-7-11-29)20-26-21-37(28-8-4-2-5-9-28)36-32(26)25-14-18-30(19-15-25)40-22-24-12-16-27(34)17-13-24/h2-21H,22H2,1H3/b31-20-InChIKey
IKVBYYFWBNDXAA-GTWSWNCMSA-NSynonyms
(4Z)4((3(4((4chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4Z)4((3(4((4CHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
CC1=NN(C(=O)C1=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=C(C=C4)Cl)C5=CC=CC=C5)C6=CC=CC=C6
Clc1ccc(cc1)COc1ccc(cc1)c1nn(cc1C=C1C(=NN(C1=O)c1ccccc1)C)c1ccccc1
InChI=1SC33H25ClN4O2c12331(33(39)38(3523)29106371129)20262137(288425928)3632(26)25141830(191525)402224121627(34)171324h221H22H21H3b3120
MFCD03461776
ZINC000097946133
ZINC97946133
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