Vitas-M small molecule compound

3-(4-methoxyphenyl)-2-thioxo-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

Catalog ID
STL380555
SMILES COc1ccc(cc1)n1c(=S)[nH]c2c(c1=O)c1CCCCc1s2

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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 C17H16N2O2S2 MW 344.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O2S2/c1-21-11-8-6-10(7-9-11)19-16(20)14-12-4-2-3-5-13(12)23-15(14)18-17(19)22/h6-9H,2-5H2,1H3,(H,18,22)
InChIKey
LYQDUKIEWRXIQB-UHFFFAOYSA-N
Synonyms
65234-02-8
3(4methoxyphenyl)2thioxo235678hexahydro(1)benzothieno(23d)pyrimidin4(1H)one
65234028
COc1ccc(cc1)n1c(=S)(nH)c2c(c1=O)c1CCCCc1s2
MFCD04087061
ZINC000000587800

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Available files

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