Vitas-M small molecule compound

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

Catalog ID
STK541131
SMILES CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)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 C27H28N2OS2 MW 460.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2OS2/c1-3-4-5-8-17-31-27-28-25-23(26(30)29(27)20-14-11-18(2)12-15-20)22-16-13-19-9-6-7-10-21(19)24(22)32-25/h6-7,9-12,14-15H,3-5,8,13,16-17H2,1-2H3
InChIKey
VBWSIFQHDZHDKX-UHFFFAOYSA-N
Synonyms
384801-22-3
384801223
9(hexylsulfanyl)8(4methylphenyl)58dihydronaphtho(2145)thieno(23d)pyrimidin7(6H)one
9(hexylthio)8(ptolyl)56dihydronaphtho(2145)thieno(23d)pyrimidin7(8H)one
CCCCCCSC1=NC2=C(C3=C(S2)C4=CC=CC=C4CC3)C(=O)N1C5=CC=C(C=C5)C
InChI=1SC27H28N2OS2c13458173127282523(26(30)29(27)20141118(2)121520)221613199671021(19)24(22)3225h679121415H358131617H212H3
MFCD01992704
ZINC000001837257
ZINC01837257
ZINC1837257

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Available files

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