Vitas-M small molecule compound

3-(1,3-benzodioxol-5-ylmethyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one

Catalog ID
STL080847
SMILES S=c1[nH]c2ccccc2c(=O)n1Cc1ccc2c(c1)OCO2

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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 C16H12N2O3S MW 312.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O3S/c19-15-11-3-1-2-4-12(11)17-16(22)18(15)8-10-5-6-13-14(7-10)21-9-20-13/h1-7H,8-9H2,(H,17,22)
InChIKey
ZUDBMZFGZPAFOZ-UHFFFAOYSA-N
Synonyms
361150-56-3
3(13benzodioxol5ylmethyl)2thioxo23dihydroquinazolin4(1H)one
361150563
MFCD02650872
S=c1(nH)c2ccccc2c(=O)n1Cc1ccc2c(c1)OCO2
ZINC000002788183

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Available files

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