Vitas-M small molecule compound
2-(4-acetylphenyl)-7,8-dimethoxy-3-thioxo-2,3,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-1(5H)-one
Catalog ID
STK207472
SMILES COc1cc2CN3C(=S)N(C(=O)C3Cc2cc1OC)c1ccc(cc1)C(=O)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 C21H20N2O4S MW 396.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O4S/c1-12(24)13-4-6-16(7-5-13)23-20(25)17-8-14-9-18(26-2)19(27-3)10-15(14)11-22(17)21(23)28/h4-7,9-10,17H,8,11H2,1-3H3InChIKey
WDMWEJQAUXYPNE-UHFFFAOYSA-NSynonyms
2(4acetylphenyl)78dimethoxy3sulfanylidene1010adihydro5Himidazo(15b)isoquinolin1one
2(4acetylphenyl)78dimethoxy3thioxo231010atetrahydroimidazo(15b)isoquinolin1(5H)one
CC(=O)C1=CC=C(C=C1)N2C(=O)C3CC4=CC(=C(C=C4CN3C2=S)OC)OC
InChI=1SC21H20N2O4Sc112(24)134616(7513)2320(25)17814918(262)19(273)1015(14)1122(17)21(23)28h4791017H811H213H3
MFCD06754416
ZINC000004761208
ZINC000004761213
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