Vitas-M small molecule compound
2-tert-butyl-7,8-dimethoxy-3-thioxo-2,3,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-1(5H)-one
Catalog ID
STL444560
SMILES COc1cc2CN3C(Cc2cc1OC)C(=O)N(C3=S)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 C17H22N2O3S MW 334.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O3S/c1-17(2,3)19-15(20)12-6-10-7-13(21-4)14(22-5)8-11(10)9-18(12)16(19)23/h7-8,12H,6,9H2,1-5H3InChIKey
XKWACDNROHXPAR-UHFFFAOYSA-NSynonyms
2tertbutyl78dimethoxy3sulfanylidene1010adihydro5Himidazo(15b)isoquinolin1one
2tertbutyl78dimethoxy3thioxo231010atetrahydroimidazo(15b)isoquinolin1(5H)one
CC(C)(C)N1C(=O)C2CC3=CC(=C(C=C3CN2C1=S)OC)OC
InChI=1SC17H22N2O3Sc117(23)1915(20)12610713(214)14(225)811(10)918(12)16(19)23h7812H69H215H3
MFCD06754419
ZINC000005274598
ZINC000005274599
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