Vitas-M small molecule compound
2-(methylsulfanyl)-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK993851
SMILES CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCCC3
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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 C18H18N2OS2 MW 342.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2OS2/c1-22-18-19-16-15(13-10-6-3-7-11-14(13)23-16)17(21)20(18)12-8-4-2-5-9-12/h2,4-5,8-9H,3,6-7,10-11H2,1H3InChIKey
MDNVSEYEYSPHSC-UHFFFAOYSA-NSynonyms
2(methylsulfanyl)3phenyl356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
2methylsulfanyl3phenyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
CSC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1C4=CC=CC=C4
InChI=1SC18H18N2OS2c12218191615(13106371114(13)2316)17(21)20(18)128425912h24589H3671011H21H3
MFCD02053058
ZINC000000068628
ZINC00068628
ZINC68628
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