Vitas-M small molecule compound
(4Z)-4-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK822953
SMILES CCOc1ccc(cc1)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 C33H26N4O2 MW 510.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26N4O2/c1-2-39-29-20-18-25(19-21-29)31-26(23-36(34-31)27-14-8-4-9-15-27)22-30-32(24-12-6-3-7-13-24)35-37(33(30)38)28-16-10-5-11-17-28/h3-23H,2H2,1H3/b30-22-InChIKey
WSTZAWSSVUSJMF-SWKFRHMKSA-NSynonyms
(4Z)4((3(4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)25diphenyl24dihydro3Hpyrazol3one
(4Z)4((3(4ethoxyphenyl)1phenylpyrazol4yl)methylidene)25diphenylpyrazol3one
CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6
CCOc1ccc(cc1)c1nn(cc1C=C1C(=NN(C1=O)c1ccccc1)c1ccccc1)c1ccccc1
InChI=1SC33H26N4O2c123929201825(192129)3126(2336(3431)27148491527)223032(24126371324)3537(33(30)38)2816105111728h323H2H21H3b3022
MFCD03463512
ZINC000027018028
ZINC27018028
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