Vitas-M small molecule compound

(4E)-4-(3,4-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK732203
SMILES COc1ccc(cc1OC)/C=C\1/C(=O)N(N=C1c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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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 C24H19N3O5 MW 429.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O5/c1-31-21-13-8-16(15-22(21)32-2)14-20-23(17-6-4-3-5-7-17)25-26(24(20)28)18-9-11-19(12-10-18)27(29)30/h3-15H,1-2H3/b20-14+
InChIKey
DHPLJAWCRSRBAU-XSFVSMFZSA-N
Synonyms

(4E)4((34DIMETHOXYPHENYL)METHYLIDENE)2(4NITROPHENYL)5PHENYLPYRAZOL3ONE
(4E)4(34dimethoxybenzylidene)2(4nitrophenyl)5phenyl24dihydro3Hpyrazol3one
(Z)4(34dimethoxybenzylidene)1(4nitrophenyl)3phenyl1Hpyrazol5(4H)one
COC1=C(C=C(C=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CC=C4)OC
COc1ccc(cc1OC)C=C1C(=O)N(N=C1c1ccccc1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H19N3O5c1312113816(1522(21)322)142023(176435717)2526(24(20)28)1891119(121018)27(29)30h315H12H3b2014+
MFCD00338225
ZINC000015636505
ZINC15636505

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Available files

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