Vitas-M small molecule compound

(4-benzyl-5-hydroxy-3,5-dimethyl-4,5-dihydro-1H-pyrazol-1-yl)(pyridin-3-yl)methanone

Catalog ID
STK396752
SMILES O=C(N1N=C(C(C1(C)O)Cc1ccccc1)C)c1cccnc1

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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 C18H19N3O2 MW 309.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O2/c1-13-16(11-14-7-4-3-5-8-14)18(2,23)21(20-13)17(22)15-9-6-10-19-12-15/h3-10,12,16,23H,11H2,1-2H3
InChIKey
ISCIGWHDJSYNCU-UHFFFAOYSA-N
Synonyms

(4benzyl5hydroxy35dimethyl45dihydro1Hpyrazol1yl)(pyridin3yl)methanone
(4BENZYL5HYDROXY35DIMETHYL4HPYRAZOL1YL)PYRIDIN3YLMETHANONE
4BENZYL35DIMETHYL1(PYRIDIN3YLCARBONYL)45DIHYDRO1HPYRAZOL5OL
5HYDROXY35DIMETHYL4BENZYL(2PYRAZOLINYL)3PYRIDYLKETONE
CC1=NN(C(C1CC2=CC=CC=C2)(C)O)C(=O)C3=CN=CC=C3
InChI=1SC18H19N3O2c11316(11147435814)18(223)21(2013)17(22)159610191215h310121623H11H212H3
MFCD00714481
ZINC000004100536
ZINC000004100542

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Available files

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