Vitas-M small molecule compound

ethyl 6-[(4-benzylpiperidin-1-yl)methyl]-4-[4-(methylsulfanyl)phenyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL107737
SMILES CCOC(=O)C1=C(CN2CCC(CC2)Cc2ccccc2)NC(=O)NC1c1ccc(cc1)SC

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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 C27H33N3O3S MW 479.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N3O3S/c1-3-33-26(31)24-23(28-27(32)29-25(24)21-9-11-22(34-2)12-10-21)18-30-15-13-20(14-16-30)17-19-7-5-4-6-8-19/h4-12,20,25H,3,13-18H2,1-2H3,(H2,28,29,32)
InChIKey
GNJYSDORRLVGPJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)SC)CN3CCC(CC3)CC4=CC=CC=C4
ethyl6((4benzylpiperidin1yl)methyl)4(4(methylsulfanyl)phenyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6((4benzylpiperidin1yl)methyl)4(4methylsulfanylphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC27H33N3O3Sc133326(31)2423(2827(32)2925(24)2191122(342)121021)1830151320(141630)17197546819h4122025H31318H212H3(H2282932)
MFCD20741665
ZINC000067286885
ZINC000067286888

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Available files

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