Vitas-M small molecule compound

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

Catalog ID
STK897982
SMILES Cc1cc(N/C=C/2\C(=NN(C2=O)c2ccccc2)C)cc(c1)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/c1-13-9-14(2)11-16(10-13)20-12-18-15(3)21-22(19(18)23)17-7-5-4-6-8-17/h4-12,20H,1-3H3/b18-12+
InChIKey
TVEIXPLCXCMHOD-LDADJPATSA-N
Synonyms

(4E)4(((35dimethylphenyl)amino)methylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4E)4((35dimethylanilino)methylidene)5methyl2phenylpyrazol3one
CC1=CC(=CC(=C1)NC=C2C(=NN(C2=O)C3=CC=CC=C3)C)C
Cc1cc(NC=C2C(=NN(C2=O)c2ccccc2)C)cc(c1)C
InChI=1SC19H19N3Oc113914(2)1116(1013)20121815(3)2122(19(18)23)177546817h41220H13H3b1812+
MFCD18172764
ZINC000044826964
ZINC44826964

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Available files

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