Vitas-M small molecule compound
1-(4-bromophenyl)-2-[(5-ethyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]ethanone
Catalog ID
STK526159
SMILES CCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)c1ccc(cc1)Br
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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 C23H20BrN3OS2 MW 498.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20BrN3OS2/c1-2-17-15-5-3-4-6-16(15)19-20-21(30-22(19)27-17)23(26-12-25-20)29-11-18(28)13-7-9-14(24)10-8-13/h7-10,12H,2-6,11H2,1H3InChIKey
PABKIAXDASOABV-UHFFFAOYSA-NSynonyms
373377-29-81(4bromophenyl)2((5ethyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)ethanone
1(4bromophenyl)2((5ethyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)ethanone
373377298
CCC1=C2CCCCC2=C3C4=C(C(=NC=N4)SCC(=O)C5=CC=C(C=C5)Br)SC3=N1
InChI=1SC23H20BrN3OS2c121715534616(15)192021(3022(19)2717)23(26122520)291118(28)137914(24)10813h71012H2611H21H3
MFCD01947379
ZINC000002280809
ZINC02280809
ZINC2280809
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