Vitas-M small molecule compound
3,4,5-trifluoro-N-[(4-methoxy-6-methyl-5-oxo-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]benzamide
Catalog ID
STL523519
SMILES COc1c2C(=O)N(C)CCc2c(c2c1OCO2)CNC(=O)c1cc(F)c(c(c1)F)F
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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 C20H17F3N2O5 MW 422.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17F3N2O5/c1-25-4-3-10-11(7-24-19(26)9-5-12(21)15(23)13(22)6-9)16-18(30-8-29-16)17(28-2)14(10)20(25)27/h5-6H,3-4,7-8H2,1-2H3,(H,24,26)InChIKey
ANRRIOSXWWMLCY-UHFFFAOYSA-NSynonyms
127253816
345trifluoro~(N)((4methoxy6methyl5oxo78dihydro(13)dioxolo(45g)isoquinolin9yl)methyl)benzamide
345trifluoroN((4methoxy6methyl5oxo5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)benzamide
InChI=1SC20H17F3N2O5c125431011(72419(26)9512(21)15(23)13(22)69)1618(3082916)17(282)14(10)20(25)27h56H3478H212H3(H2426)
MFCD31752951
ZINC000604403854
ZINC604403854
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