Vitas-M small molecule compound

3-methyl-1-phenyl-6-(thiophen-2-yl)-1,5,6,7-tetrahydro-4H-indazol-4-one

Catalog ID
STK235453
SMILES O=C1CC(Cc2c1c(C)nn2c1ccccc1)c1cccs1

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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 C18H16N2OS MW 308.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2OS/c1-12-18-15(20(19-12)14-6-3-2-4-7-14)10-13(11-16(18)21)17-8-5-9-22-17/h2-9,13H,10-11H2,1H3
InChIKey
RVNDQDQLGPMKGP-UHFFFAOYSA-N
Synonyms
878994-50-4
3methyl1phenyl6(thiophen2yl)1567tetrahydro4Hindazol4one
3methyl1phenyl6(thiophen2yl)67dihydro1Hindazol4(5H)one
3METHYL1PHENYL6THIOPHEN2YL67DIHYDRO5HINDAZOL4ONE
878994504
CC1=NN(C2=C1C(=O)CC(C2)C3=CC=CS3)C4=CC=CC=C4
InChI=1SC18H16N2OSc1121815(20(1912)146324714)1013(1116(18)21)178592217h2913H1011H21H3
MFCD07403372
ZINC000004992922
ZINC000004992923

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Available files

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