Vitas-M small molecule compound

3-benzyl-2-(hexylsulfanyl)quinazolin-4(3H)-one

Catalog ID
STK804998
SMILES CCCCCCSc1nc2ccccc2c(=O)n1Cc1ccccc1

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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 C21H24N2OS MW 352.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2OS/c1-2-3-4-10-15-25-21-22-19-14-9-8-13-18(19)20(24)23(21)16-17-11-6-5-7-12-17/h5-9,11-14H,2-4,10,15-16H2,1H3
InChIKey
RQARICFBRNKIPB-UHFFFAOYSA-N
Synonyms

3benzyl2(hexylsulfanyl)quinazolin4(3H)one
3benzyl2(hexylthio)quinazolin4(3H)one
3BENZYL2HEXYLSULFANYL3HQUINAZOLIN4ONE
3BENZYL2HEXYLSULFANYLQUINAZOLIN4ONE
CCCCCCSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3
InChI=1SC21H24N2OSc123410152521221914981318(19)20(24)23(21)1617116571217h591114H24101516H21H3
MFCD02044906
ZINC000002294415
ZINC02294415
ZINC2294415

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Available files

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