Vitas-M small molecule compound

2-methyl-N-(2-methylacryloyl)-N-(5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)prop-2-enamide

Catalog ID
STK088475
SMILES O=C1CC(=NN1c1ccccc1)N(C(=O)C(=C)C)C(=O)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 C17H17N3O3 MW 311.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O3/c1-11(2)16(22)19(17(23)12(3)4)14-10-15(21)20(18-14)13-8-6-5-7-9-13/h5-9H,1,3,10H2,2,4H3
InChIKey
CEOPICHIMYVGKA-UHFFFAOYSA-N
Synonyms

2METHYLN(2METHYLACRYLOYL)N(5OXO1PHENYL45DIHYDRO1HPYRAZOL3YL)PROP2ENAMIDE
2METHYLN(2METHYLPROP2ENOYL)N(5OXO1PHENYL4HPYRAZOL3YL)PROP2ENAMIDE
CC(=C)C(=O)N(C1=NN(C(=O)C1)C2=CC=CC=C2)C(=O)C(=C)C
InChI=1SC17H17N3O3c111(2)16(22)19(17(23)12(3)4)141015(21)20(1814)138657913h59H1310H224H3
MFCD03033098
O=C1CC(=NN1c1ccccc1)N(C(=O)C(=C)C)C(=O)C(=C)C
STK088475
ZINC000004673241
ZINC04673241
ZINC4673241

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Available files

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