Vitas-M small molecule compound
2-[(2-bromoprop-2-en-1-yl)sulfanyl]-7-tert-butyl-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK984207
SMILES BrC(=C)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCC(C3)C(C)(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 C23H25BrN2OS2 MW 489.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25BrN2OS2/c1-14(24)13-28-22-25-20-19(21(27)26(22)16-8-6-5-7-9-16)17-11-10-15(23(2,3)4)12-18(17)29-20/h5-9,15H,1,10-13H2,2-4H3InChIKey
BPCQATSRSWGAFC-UHFFFAOYSA-NSynonyms
2((2bromoprop2en1yl)sulfanyl)7tertbutyl3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(2bromoprop2enylsulfanyl)7tertbutyl3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=C)Br)C4=CC=CC=C4
InChI=1SC23H25BrN2OS2c114(24)132822252019(21(27)26(22)168657916)17111015(23(23)4)1218(17)2920h5915H11013H224H3
MFCD01907399
ZINC000002183172
ZINC000002183173
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