Vitas-M small molecule compound
1-(4-bromophenyl)-2-{[9-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}ethanone
Catalog ID
STK541292
SMILES CSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)Br)nn2)CCC(C3)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 C21H19BrN4OS3 MW 519.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN4OS3/c1-11-3-8-14-16(9-11)30-19-17(14)18-24-25-21(26(18)20(23-19)28-2)29-10-15(27)12-4-6-13(22)7-5-12/h4-7,11H,3,8-10H2,1-2H3InChIKey
AGMWNQVLDOOGAT-UHFFFAOYSA-NSynonyms
385419-67-01(4bromophenyl)2((9methyl5(methylsulfanyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)ethanone
1(4bromophenyl)2((9methyl5(methylthio)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)ethanone
385419670
CC1CCC2=C(C1)SC3=C2C4=NN=C(N4C(=N3)SC)SCC(=O)C5=CC=C(C=C5)Br
InChI=1SC21H19BrN4OS3c111381416(911)301917(14)18242521(26(18)20(2319)282)291015(27)124613(22)7512h4711H3810H212H3
MFCD02235625
ZINC000001762126
ZINC000001762129
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