Vitas-M small molecule compound

1-(1-benzofuran-2-yl)-2-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone

Catalog ID
STL344427
SMILES Cc1nc(SCC(=O)c2oc3c(c2)cccc3)c2c(n1)c1ccccc1o2

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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 C21H14N2O3S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N2O3S/c1-12-22-19-14-7-3-5-9-17(14)26-20(19)21(23-12)27-11-15(24)18-10-13-6-2-4-8-16(13)25-18/h2-10H,11H2,1H3
InChIKey
MYVOHMNROAKURT-UHFFFAOYSA-N
Synonyms
846597-36-2
1(1benzofuran2yl)2((2methyl(1)benzofuro(32d)pyrimidin4yl)sulfanyl)ethanone
1(benzofuran2yl)2((2methylbenzofuro(32d)pyrimidin4yl)thio)ethanone
846597362
CC1=NC2=C(C(=N1)SCC(=O)C3=CC4=CC=CC=C4O3)OC5=CC=CC=C52
InChI=1SC21H14N2O3Sc112221914735917(14)2620(19)21(2312)271115(24)181013624816(13)2518h210H11H21H3
MFCD04176710
ZINC000002404684
ZINC02404684
ZINC2404684

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Available files

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