Vitas-M small molecule compound

ethyl 1-ethyl-6-{[(furan-2-ylmethyl)sulfanyl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK313657
SMILES CCOC(=O)C1=C(CSCc2ccco2)N(C(=O)NC1c1ccccc1)CC

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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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c1-3-23-17(14-28-13-16-11-8-12-27-16)18(20(24)26-4-2)19(22-21(23)25)15-9-6-5-7-10-15/h5-12,19H,3-4,13-14H2,1-2H3,(H,22,25)
InChIKey
WTCHUSRJHQOBAS-UHFFFAOYSA-N
Synonyms
832742-74-2
832742742
CCN1C(=C(C(NC1=O)C2=CC=CC=C2)C(=O)OCC)CSCC3=CC=CO3
ethyl1ethyl6(((furan2ylmethyl)sulfanyl)methyl)2oxo4phenyl1234tetrahydropyrimidine5carboxylate
ethyl3ethyl4(furan2ylmethylsulfanylmethyl)2oxo6phenyl16dihydropyrimidine5carboxylate
InChI=1SC21H24N2O4Sc132317(14281316118122716)18(20(24)2642)19(2221(23)25)1596571015h51219H341314H212H3(H2225)
MFCD05667282
ZINC000002732775
ZINC000002732776

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Available files

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