Vitas-M small molecule compound
3-benzyl-2-(benzylsulfanyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK831048
SMILES O=c1c2c(sc3c2CCCCC3)nc(n1Cc1ccccc1)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 C25H24N2OS2 MW 432.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2OS2/c28-24-22-20-14-8-3-9-15-21(20)30-23(22)26-25(29-17-19-12-6-2-7-13-19)27(24)16-18-10-4-1-5-11-18/h1-2,4-7,10-13H,3,8-9,14-17H2InChIKey
MAJQHMUJQDCHKO-UHFFFAOYSA-NSynonyms
3benzyl2(benzylsulfanyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3benzyl2(benzylthio)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3benzyl2benzylsulfanyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
C1CCC2=C(CC1)SC3=C2C(=O)N(C(=N3)SCC4=CC=CC=C4)CC5=CC=CC=C5
InChI=1SC25H24N2OS2c28242220148391521(20)3023(22)2625(291719126271319)27(24)1618104151118h12471013H3891417H2
MFCD01959921
ZINC000002289345
ZINC02289345
ZINC2289345
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