Vitas-M small molecule compound
2-(3,4-dimethylphenyl)-4-{[(2,5-dimethylphenyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK751238
SMILES Cc1ccc(c(c1)N/C=C/1\C(=NN(C1=O)c1ccc(c(c1)C)C)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 C21H23N3O MW 333.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O/c1-13-6-7-15(3)20(10-13)22-12-19-17(5)23-24(21(19)25)18-9-8-14(2)16(4)11-18/h6-12,22H,1-5H3/b19-12+InChIKey
LJNQJGFQABMLAE-XDHOZWIPSA-NSynonyms
(4E)4((25DIMETHYLANILINO)METHYLIDENE)2(34DIMETHYLPHENYL)5METHYLPYRAZOL3ONE
2(34dimethylphenyl)4(((25dimethylphenyl)amino)methylidene)5methyl24dihydro3Hpyrazol3one
CC1=CC(=C(C=C1)C)NC=C2C(=NN(C2=O)C3=CC(=C(C=C3)C)C)C
Cc1ccc(c(c1)NC=C1C(=NN(C1=O)c1ccc(c(c1)C)C)C)C
InChI=1SC21H23N3Oc1136715(3)20(1013)22121917(5)2324(21(19)25)189814(2)16(4)1118h61222H15H3b1912+
MFCD00746636
ZINC000006556638
ZINC000096793231
ZINC06556638
ZINC96793231
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