Vitas-M small molecule compound
(4E)-4-{3-chloro-5-methoxy-4-[(4-methylbenzyl)oxy]benzylidene}-1-phenylpyrazolidine-3,5-dione
Catalog ID
STK064416
SMILES COc1cc(/C=C/2\C(=O)NN(C2=O)c2ccccc2)cc(c1OCc1ccc(cc1)C)Cl
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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 C25H21ClN2O4 MW 448.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O4/c1-16-8-10-17(11-9-16)15-32-23-21(26)13-18(14-22(23)31-2)12-20-24(29)27-28(25(20)30)19-6-4-3-5-7-19/h3-14H,15H2,1-2H3,(H,27,29)/b20-12+InChIKey
XZOKBYBJEHKFAE-UDWIEESQSA-NSynonyms
(4E)4((3CHLORO5METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(3CHLORO5METHOXY4((4METHYLBENZYL)OXY)BENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
4(3CHLORO5METHOXY4((4METHYLBENZYL)OXY)BENZYLIDENE)1PHENYL35PYRAZOLIDINEDIONE
CC1=CC=C(C=C1)COC2=C(C=C(C=C2Cl)C=C3C(=O)NN(C3=O)C4=CC=CC=C4)OC
COc1cc(C=C2C(=O)NN(C2=O)c2ccccc2)cc(c1OCc1ccc(cc1)C)Cl
InChI=1SC25H21ClN2O4c11681017(11916)15322321(26)1318(1422(23)312)122024(29)2728(25(20)30)196435719h314H15H212H3(H2729)b2012+
MFCD03083814
STK064416
ZINC000000640850
ZINC00640850
ZINC640850
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