Vitas-M small molecule compound
tert-butyl 4-{[6-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-3-hydroxy-4-oxo-4H-pyran-2-yl]methyl}piperazine-1-carboxylate
Catalog ID
STL422049
SMILES O=C(N1CCN(CC1)Cc1oc(CN2CCc3c(C2)cccc3)cc(=O)c1O)OC(C)(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 C25H33N3O5 MW 455.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N3O5/c1-25(2,3)33-24(31)28-12-10-26(11-13-28)17-22-23(30)21(29)14-20(32-22)16-27-9-8-18-6-4-5-7-19(18)15-27/h4-7,14,30H,8-13,15-17H2,1-3H3InChIKey
PROTXRSAUCDEEL-UHFFFAOYSA-NSynonyms
1630872-76-21630872762
CC(C)(C)OC(=O)N1CCN(CC1)CC2=C(C(=O)C=C(O2)CN3CCC4=CC=CC=C4C3)O
InChI=1SC25H33N3O5c125(23)3324(31)28121026(111328)172223(30)21(29)1420(3222)16279818645719(18)1527h471430H8131517H213H3
MFCD28367650
tertbutyl4((6((34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)methyl)piperazine1carboxylate
tertbutyl4((6(34dihydro1Hisoquinolin2ylmethyl)3hydroxy4oxopyran2yl)methyl)piperazine1carboxylate
tertbutyl4((6(34dihydroisoquinolin2(1H)ylmethyl)3hydroxy4oxo4Hpyran2yl)methyl)piperazine1carboxylate
ZINC000218291970
ZINC218291970
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