Vitas-M small molecule compound

(4Z)-4-(1-ethoxyethylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK262275
SMILES CCO/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 C14H16N2O2 MW 244.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O2/c1-4-18-11(3)13-10(2)15-16(14(13)17)12-8-6-5-7-9-12/h5-9H,4H2,1-3H3/b13-11-
InChIKey
VRDGRMDXQILLDO-QBFSEMIESA-N
Synonyms

(4Z)4(1ethoxyethylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4Z)4(1ethoxyethylidene)5methyl2phenylpyrazol3one
4(ETHOXYETHYLIDENE)3METHYL1PHENYL12DIAZOLIN5ONE
CCOC(=C1C(=NN(C1=O)c1ccccc1)C)C
CCOC(=C1C(=NN(C1=O)C2=CC=CC=C2)C)C
InChI=1SC14H16N2O2c141811(3)1310(2)1516(14(13)17)128657912h59H4H213H3b1311
MFCD08547592
ZINC000009482453
ZINC09482453
ZINC9482453

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Available files

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