Vitas-M small molecule compound
2-(benzylsulfanyl)-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK831074
SMILES O=c1c2c(sc3c2CCCCC3)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 C24H22N2OS2 MW 418.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2OS2/c27-23-21-19-14-8-3-9-15-20(19)29-22(21)25-24(26(23)18-12-6-2-7-13-18)28-16-17-10-4-1-5-11-17/h1-2,4-7,10-13H,3,8-9,14-16H2InChIKey
ICBBQNAFEJHWBJ-UHFFFAOYSA-NSynonyms
351159-71-22(benzylsulfanyl)3phenyl356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
2(benzylthio)3phenyl6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
2benzylsulfanyl3phenyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
351159712
C1CCC2=C(CC1)SC3=C2C(=O)N(C(=N3)SCC4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC24H22N2OS2c27232119148391520(19)2922(21)2524(26(23)18126271318)281617104151117h12471013H3891416H2
MFCD01877115
ZINC000002066418
ZINC02066418
ZINC2066418
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