Vitas-M small molecule compound
3-(4-ethylphenyl)-2-(prop-2-en-1-ylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL369859
SMILES C=CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)CC)CCCC3
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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 C21H22N2OS2 MW 382.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2OS2/c1-3-13-25-21-22-19-18(16-7-5-6-8-17(16)26-19)20(24)23(21)15-11-9-14(4-2)10-12-15/h3,9-12H,1,4-8,13H2,2H3InChIKey
FMJHAODIPHPUHE-UHFFFAOYSA-NSynonyms
3(4ethylphenyl)2(prop2en1ylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4ethylphenyl)2prop2enylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC=C)SC4=C3CCCC4
InChI=1SC21H22N2OS2c13132521221918(16756817(16)2619)20(24)23(21)1511914(42)101215h3912H14813H22H3
MFCD03864629
ZINC000002143291
ZINC02143291
ZINC2143291
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