Vitas-M small molecule compound
3-[1-(1-ethyl-3-methyl-1H-pyrazol-4-yl)ethyl]-2-sulfanyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK448947
SMILES CCn1nc(c(c1)C(n1c(S)nc2c(c1=O)c1CCCCCc1s2)C)C
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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 C19H24N4OS2 MW 388.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N4OS2/c1-4-22-10-14(11(2)21-22)12(3)23-18(24)16-13-8-6-5-7-9-15(13)26-17(16)20-19(23)25/h10,12H,4-9H2,1-3H3,(H,20,25)InChIKey
BMEFVADDCKGYCR-UHFFFAOYSA-NSynonyms
3(1(1ethyl3methyl1Hpyrazol4yl)ethyl)2sulfanyl356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(1(1ethyl3methylpyrazol4yl)ethyl)2sulfanylidene156789hexahydrocyclohepta(23)thieno(24b)pyrimidin4one
CCN1C=C(C(=N1)C)C(C)N2C(=O)C3=C(NC2=S)SC4=C3CCCCC4
InChI=1SC19H24N4OS2c14221014(11(2)2122)12(3)2318(24)16138657915(13)2617(16)2019(23)25h1012H49H213H3(H2025)
MFCD06091100
ZINC000017079380
ZINC000017079381
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