Vitas-M small molecule compound
2-(prop-2-en-1-ylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK918650
SMILES COc1cc(cc(c1OC)OC)C1C2=C(CCCC2=O)Nc2c1c(=O)[nH]c(n2)SCC=C
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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 C23H25N3O5S MW 455.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O5S/c1-5-9-32-23-25-21-19(22(28)26-23)17(18-13(24-21)7-6-8-14(18)27)12-10-15(29-2)20(31-4)16(11-12)30-3/h5,10-11,17H,1,6-9H2,2-4H3,(H2,24,25,26,28)InChIKey
MFRLDTRICWQJAD-UHFFFAOYSA-NSynonyms
627045-95-82(prop2en1ylsulfanyl)5(345trimethoxyphenyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
2prop2enylsulfanyl5(345trimethoxyphenyl)1578910hexahydropyrimido(45b)quinoline46dione
627045958
COC1=CC(=CC(=C1OC)OC)C2C3=C(CCCC3=O)NC4=C2C(=O)N=C(N4)SCC=C
COc1cc(cc(c1OC)OC)C1C2=C(CCCC2=O)Nc2c1c(=O)(nH)c(n2)SCC=C
InChI=1SC23H25N3O5Sc1593223252119(22(28)2623)17(1813(2421)76814(18)27)121015(292)20(314)16(1112)303h5101117H169H224H3(H224252628)
MFCD05744618
ZINC000006143641
ZINC000006143642
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