Vitas-M small molecule compound
2-(3-chloro-6-oxopyridazin-1(6H)-yl)-N-[(4-hydroxy-6-methyl-5-oxo-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]acetamide
Catalog ID
STL523533
SMILES O=C(Cn1nc(Cl)ccc1=O)NCc1c2OCOc2c(c2c1CCN(C2=O)C)O
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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 C18H17ClN4O6 MW 420.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O6/c1-22-5-4-9-10(16-17(29-8-28-16)15(26)14(9)18(22)27)6-20-12(24)7-23-13(25)3-2-11(19)21-23/h2-3,26H,4-8H2,1H3,(H,20,24)InChIKey
YHIQFTPIPAUREG-UHFFFAOYSA-NSynonyms
132352407
2(3chloro6oxopyridazin1(6H)yl)N((4hydroxy6methyl5oxo5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)acetamide
2(3chloro6oxopyridazin1yl)~(N)((4hydroxy6methyl5oxo78dihydro(13)dioxolo(45g)isoquinolin9yl)methyl)acetamide
InChI=1SC18H17ClN4O6c12254910(1617(2982816)15(26)14(9)18(22)27)62012(24)72313(25)3211(19)2123h2326H48H21H3(H2024)
MFCD31752965
ZINC000827864783
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