Vitas-M small molecule compound
N-[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]-3-[(3-methylbutanoyl)amino]benzamide
Catalog ID
STL523581
SMILES COc1c2CN(C)CCc2c(c2c1OCO2)CNC(=O)c1cccc(c1)NC(=O)CC(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 C25H31N3O5 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O5/c1-15(2)10-21(29)27-17-7-5-6-16(11-17)25(30)26-12-19-18-8-9-28(3)13-20(18)22(31-4)24-23(19)32-14-33-24/h5-7,11,15H,8-10,12-14H2,1-4H3,(H,26,30)(H,27,29)InChIKey
KSQBEPKKUUEJCK-UHFFFAOYSA-NSynonyms
~(N)((4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin9yl)methyl)3(3methylbutanoylamino)benzamide
125429091
InChI=1SC25H31N3O5c115(2)1021(29)271775616(1117)25(30)261219188928(3)1320(18)22(314)2423(19)32143324h571115H8101214H214H3(H2630)(H2729)
MFCD31753013
N((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)3((3methylbutanoyl)amino)benzamide
N((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)3(3methylbutanamido)benzamide
ZINC000524730480
ZINC524730480
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