Vitas-M small molecule compound
3-(4-methoxyphenyl)-2-(methylsulfanyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK722084
SMILES COc1ccc(cc1)n1c(SC)nc2c(c1=O)c1CCCCCc1s2
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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 C19H20N2O2S2 MW 372.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O2S2/c1-23-13-10-8-12(9-11-13)21-18(22)16-14-6-4-3-5-7-15(14)25-17(16)20-19(21)24-2/h8-11H,3-7H2,1-2H3InChIKey
FOKQGWQLXIYBDC-UHFFFAOYSA-NSynonyms
373610-05-03(4methoxyphenyl)2(methylsulfanyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(4methoxyphenyl)2(methylthio)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3(4methoxyphenyl)2methylsulfanyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
373610050
COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SC)SC4=C3CCCCC4
InChI=1SC19H20N2O2S2c1231310812(91113)2118(22)16146435715(14)2517(16)2019(21)242h811H37H212H3
MFCD01947571
ZINC000002280933
ZINC02280933
ZINC2280933
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