Vitas-M small molecule compound

3-benzyl-2-(benzylsulfanyl)-6-iodoquinazolin-4(3H)-one

Catalog ID
STK543327
SMILES Ic1ccc2c(c1)c(=O)n(c(n2)SCc1ccccc1)Cc1ccccc1

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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 C22H17IN2OS MW 484.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17IN2OS/c23-18-11-12-20-19(13-18)21(26)25(14-16-7-3-1-4-8-16)22(24-20)27-15-17-9-5-2-6-10-17/h1-13H,14-15H2
InChIKey
USVRKVQRYKXVRO-UHFFFAOYSA-N
Synonyms
488108-66-3
3benzyl2(benzylsulfanyl)6iodoquinazolin4(3H)one
3benzyl2(benzylthio)6iodoquinazolin4(3H)one
3BENZYL2BENZYLSULFANYL6IODOQUINAZOLIN4ONE
488108663
C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC4=CC=CC=C4
InChI=1SC22H17IN2OSc231811122019(1318)21(26)25(14167314816)22(2420)27151795261017h113H1415H2
MFCD03288958
ZINC000001660360
ZINC01660360
ZINC1660360

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Available files

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