Vitas-M small molecule compound
ethyl 4-[4-(methylsulfanyl)phenyl]-2-oxo-6-[(4-phenyl-3,6-dihydropyridin-1(2H)-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107745
SMILES CCOC(=O)C1=C(CN2CCC(=CC2)c2ccccc2)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 C26H29N3O3S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O3S/c1-3-32-25(30)23-22(17-29-15-13-19(14-16-29)18-7-5-4-6-8-18)27-26(31)28-24(23)20-9-11-21(33-2)12-10-20/h4-13,24H,3,14-17H2,1-2H3,(H2,27,28,31)InChIKey
ATWOEFGNSAWQIG-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)SC)CN3CCC(=CC3)C4=CC=CC=C4
ethyl4(4(methylsulfanyl)phenyl)2oxo6((4phenyl36dihydropyridin1(2H)yl)methyl)1234tetrahydropyrimidine5carboxylate
ethyl4(4methylsulfanylphenyl)2oxo6((4phenyl36dihydro2Hpyridin1yl)methyl)34dihydro1Hpyrimidine5carboxylate
InChI=1SC26H29N3O3Sc133225(30)2322(1729151319(141629)187546818)2726(31)2824(23)2091121(332)121020h41324H31417H212H3(H2272831)
MFCD20741673
ZINC000067286939
ZINC000067286942
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