Vitas-M small molecule compound
9-(benzylsulfanyl)-8-cyclohexyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Catalog ID
STK532114
SMILES O=c1c2c(sc3c2CCc2c3cccc2)nc(n1C1CCCCC1)SCc1ccccc1
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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 C27H26N2OS2 MW 458.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2OS2/c30-26-23-22-16-15-19-11-7-8-14-21(19)24(22)32-25(23)28-27(29(26)20-12-5-2-6-13-20)31-17-18-9-3-1-4-10-18/h1,3-4,7-11,14,20H,2,5-6,12-13,15-17H2InChIKey
LIRJSNULHHTHKN-UHFFFAOYSA-NSynonyms
9(benzylsulfanyl)8cyclohexyl58dihydronaphtho(2145)thieno(23d)pyrimidin7(6H)one
9(benzylthio)8cyclohexyl56dihydronaphtho(2145)thieno(23d)pyrimidin7(8H)one
C1CCC(CC1)N2C(=O)C3=C(N=C2SCC4=CC=CC=C4)SC5=C3CCC6=CC=CC=C65
InChI=1SC27H26N2OS2c3026232216151911781421(19)24(22)3225(23)2827(29(26)20125261320)31171893141018h1347111420H25612131517H2
MFCD01992650
ZINC000002251521
ZINC02251521
ZINC2251521
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