Vitas-M small molecule compound

3-[({3-[2-(dimethylamino)ethyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)methyl]benzonitrile

Catalog ID
STL106307
SMILES N#Cc1cccc(c1)CSc1nc2ccccc2c(=O)n1CCN(C)C

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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 C20H20N4OS MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4OS/c1-23(2)10-11-24-19(25)17-8-3-4-9-18(17)22-20(24)26-14-16-7-5-6-15(12-16)13-21/h3-9,12H,10-11,14H2,1-2H3
InChIKey
FPACHTGEGVCBGG-UHFFFAOYSA-N
Synonyms

3(((3(2(dimethylamino)ethyl)4oxo34dihydroquinazolin2yl)sulfanyl)methyl)benzonitrile
3((3(2(dimethylamino)ethyl)4oxoquinazolin2yl)sulfanylmethyl)benzonitrile
CN(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=CC(=C3)C#N
InChI=1SC20H20N4OSc123(2)10112419(25)17834918(17)2220(24)26141675615(1216)1321h3912H101114H212H3
MFCD20737655
ZINC000067258701
ZINC67258701

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Available files

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