Vitas-M small molecule compound

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

Catalog ID
STK838210
SMILES COc1ccccc1n1cnc2c(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 C17H16N2O2S MW 312.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O2S/c1-21-13-8-4-3-7-12(13)19-10-18-16-15(17(19)20)11-6-2-5-9-14(11)22-16/h3-4,7-8,10H,2,5-6,9H2,1H3
InChIKey
RKAVADZLNICDGW-UHFFFAOYSA-N
Synonyms

3(2methoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(2methoxyphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
3(2methoxyphenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
COC1=CC=CC=C1N2C=NC3=C(C2=O)C4=C(S3)CCCC4
InChI=1SC17H16N2O2Sc12113843712(13)1910181615(17(19)20)11625914(11)2216h347810H2569H21H3
MFCD00405496
ZINC000000503830
ZINC00503830
ZINC503830

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Available files

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