Vitas-M small molecule compound
7-methyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK996423
SMILES CC(=C)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCC(C3)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 C21H22N2OS2 MW 382.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2OS2/c1-13(2)12-25-21-22-19-18(16-10-9-14(3)11-17(16)26-19)20(24)23(21)15-7-5-4-6-8-15/h4-8,14H,1,9-12H2,2-3H3InChIKey
QJXRTFUPLSQFDD-UHFFFAOYSA-NSynonyms
7methyl2((2methylprop2en1yl)sulfanyl)3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7methyl2(2methylprop2enylsulfanyl)3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=C)C)C4=CC=CC=C4
InChI=1SC21H22N2OS2c113(2)122521221918(1610914(3)1117(16)2619)20(24)23(21)157546815h4814H1912H223H3
MFCD02238063
ZINC000005608046
ZINC000005608051
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