Vitas-M small molecule compound

3-methyl-6-(3-methylphenyl)-1-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one

Catalog ID
STK235454
SMILES Cc1cccc(c1)C1CC(=O)c2c(C1)n(nc2C)c1ccccc1

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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 C21H20N2O MW 316.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O/c1-14-7-6-8-16(11-14)17-12-19-21(20(24)13-17)15(2)22-23(19)18-9-4-3-5-10-18/h3-11,17H,12-13H2,1-2H3
InChIKey
ILAMYCQZKFKPNW-UHFFFAOYSA-N
Synonyms
878994-51-5
3methyl1phenyl6(mtolyl)67dihydro1Hindazol4(5H)one
3methyl6(3methylphenyl)1phenyl1567tetrahydro4Hindazol4one
3METHYL6(3METHYLPHENYL)1PHENYL67DIHYDRO5HINDAZOL4ONE
878994515
CC1=CC=CC(=C1)C2CC3=C(C(=NN3C4=CC=CC=C4)C)C(=O)C2
InChI=1SC21H20N2Oc11476816(1114)17121921(20(24)1317)15(2)2223(19)1894351018h31117H1213H212H3
MFCD07469791
ZINC000005451220
ZINC000005451221

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Available files

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