Vitas-M small molecule compound

(4E)-4-{[(2,5-dimethylphenyl)amino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK897981
SMILES Cc1ccc(c(c1)N/C=C/1\C(=NN(C1=O)c1ccccc1)C)C

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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 C19H19N3O MW 305.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O/c1-13-9-10-14(2)18(11-13)20-12-17-15(3)21-22(19(17)23)16-7-5-4-6-8-16/h4-12,20H,1-3H3/b17-12+
InChIKey
SXSBIZKHWNKVIP-SFQUDFHCSA-N
Synonyms

(4E)4(((25dimethylphenyl)amino)methylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4E)4((25DIMETHYLANILINO)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
CC1=CC(=C(C=C1)C)NC=C2C(=NN(C2=O)C3=CC=CC=C3)C
Cc1ccc(c(c1)NC=C1C(=NN(C1=O)c1ccccc1)C)C
InChI=1SC19H19N3Oc11391014(2)18(1113)20121715(3)2122(19(17)23)167546816h41220H13H3b1712+
MFCD02632803
ZINC000005002958
ZINC05002958
ZINC5002958

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.