Vitas-M small molecule compound

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

Catalog ID
STL346028
SMILES Cc1ccc(cc1)C(=O)CSc1nc(C)nc2c1oc1c2cccc1

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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 C20H16N2O2S MW 348.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O2S/c1-12-7-9-14(10-8-12)16(23)11-25-20-19-18(21-13(2)22-20)15-5-3-4-6-17(15)24-19/h3-10H,11H2,1-2H3
InChIKey
KQUFSHQKEJIEFA-UHFFFAOYSA-N
Synonyms
848735-42-2
2((2methyl(1)benzofuro(32d)pyrimidin4yl)sulfanyl)1(4methylphenyl)ethanone
2((2methylbenzofuro(32d)pyrimidin4yl)thio)1(ptolyl)ethanone
848735422
CC1=CC=C(C=C1)C(=O)CSC2=NC(=NC3=C2OC4=CC=CC=C43)C
InChI=1SC20H16N2O2Sc1127914(10812)16(23)1125201918(2113(2)2220)15534617(15)2419h310H11H212H3
MFCD04194428
ZINC000005254219
ZINC05254219
ZINC5254219

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Available files

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