Vitas-M small molecule compound
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6,6-dimethyl-3-(2-methylprop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK083857
SMILES CC(=C)Cn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CC(C)(C)OCc1s2
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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 C23H23BrN2O3S2 MW 519.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23BrN2O3S2/c1-13(2)10-26-21(28)19-16-9-23(3,4)29-11-18(16)31-20(19)25-22(26)30-12-17(27)14-5-7-15(24)8-6-14/h5-8H,1,9-12H2,2-4H3InChIKey
LERUBCWJZVHQQQ-UHFFFAOYSA-NSynonyms
353762-77-32((2(4bromophenyl)2oxoethyl)sulfanyl)66dimethyl3(2methylprop2en1yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2((2(4bromophenyl)2oxoethyl)thio)66dimethyl3(2methylallyl)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2(2(4bromophenyl)2oxoethyl)sulfanyl66dimethyl3(2methylprop2enyl)58dihydropyrano(23)thieno(24b)pyrimidin4one
353762773
CC(=C)CN1C(=O)C2=C(N=C1SCC(=O)C3=CC=C(C=C3)Br)SC4=C2CC(OC4)(C)C
CC(=C)Cn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CC(C)(C)OCc1s2
InChI=1SC23H23BrN2O3S2c113(2)102621(28)1916923(34)291118(16)3120(19)2522(26)301217(27)145715(24)8614h58H1912H224H3
MFCD01558597
STK083857
ZINC000000680191
ZINC00680191
ZINC680191
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