Vitas-M small molecule compound

9-[(4-bromobenzyl)sulfanyl]-8-cyclohexyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one

Catalog ID
STK544940
SMILES Brc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCc1c3cccc1

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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 C27H25BrN2OS2 MW 537.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25BrN2OS2/c28-19-13-10-17(11-14-19)16-32-27-29-25-23(26(31)30(27)20-7-2-1-3-8-20)22-15-12-18-6-4-5-9-21(18)24(22)33-25/h4-6,9-11,13-14,20H,1-3,7-8,12,15-16H2
InChIKey
AEHRNTTUKXJSBJ-UHFFFAOYSA-N
Synonyms
488726-61-0
488726610
9((4bromobenzyl)sulfanyl)8cyclohexyl58dihydronaphtho(2145)thieno(23d)pyrimidin7(6H)one
9((4bromobenzyl)thio)8cyclohexyl56dihydronaphtho(2145)thieno(23d)pyrimidin7(8H)one
C1CCC(CC1)N2C(=O)C3=C(N=C2SCC4=CC=C(C=C4)Br)SC5=C3CCC6=CC=CC=C65
InChI=1SC27H25BrN2OS2c2819131017(111419)163227292523(26(31)30(27)207213820)22151218645921(18)24(22)3325h46911131420H1378121516H2
MFCD03291635
ZINC000001820183
ZINC01820183
ZINC1820183

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Available files

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