Vitas-M small molecule compound
ethyl 4-{[3-(1,3-benzodioxol-5-yl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinolin-4-yl]carbonyl}piperazine-1-carboxylate
Catalog ID
STL319446
SMILES CCOC(=O)N1CCN(CC1)C(=O)C1c2ccccc2C(=O)N(C1c1ccc2c(c1)OCO2)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 C25H27N3O6 MW 465.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O6/c1-3-32-25(31)28-12-10-27(11-13-28)24(30)21-17-6-4-5-7-18(17)23(29)26(2)22(21)16-8-9-19-20(14-16)34-15-33-19/h4-9,14,21-22H,3,10-13,15H2,1-2H3InChIKey
HNQHVWQOONRYST-UHFFFAOYSA-NSynonyms
1435977-95-91435977959
CCOC(=O)N1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CC5=C(C=C4)OCO5
ethyl4((3(13benzodioxol5yl)2methyl1oxo1234tetrahydroisoquinolin4yl)carbonyl)piperazine1carboxylate
ethyl4(3(13benzodioxol5yl)2methyl1oxo34dihydroisoquinoline4carbonyl)piperazine1carboxylate
ethyl4(3(benzo(d)(13)dioxol5yl)2methyl1oxo1234tetrahydroisoquinoline4carbonyl)piperazine1carboxylate
InChI=1SC25H27N3O6c133225(31)28121027(111328)24(30)2117645718(17)23(29)26(2)22(21)16891920(1416)34153319h49142122H3101315H212H3
MFCD23139648
ZINC000095480074
ZINC000095480077
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