Vitas-M small molecule compound
5-(1-{[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]amino}ethylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL548091
SMILES COc1c2c(CCN(C2CNC(=C2C(=O)N(C)C(=O)N(C2=O)C)C)C)cc2c1OCO2
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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 C21H26N4O6 MW 430.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O6/c1-11(15-19(26)24(3)21(28)25(4)20(15)27)22-9-13-16-12(6-7-23(13)2)8-14-17(18(16)29-5)31-10-30-14/h8,13,22H,6-7,9-10H2,1-5H3InChIKey
AOCZRBCONDSLDA-UHFFFAOYSA-NSynonyms
5(1(((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)methyl)amino)ethylidene)13dimethylpyrimidine246(1H3H5H)trione
InChI=1SC21H26N4O6c111(1519(26)24(3)21(28)25(4)20(15)27)229131612(6723(13)2)81417(18(16)295)31103014h81322H67910H215H3
MFCD04145660
ZINC000020412148
ZINC000020412152
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