Vitas-M small molecule compound
3-(4-chlorophenyl)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-4-(1H-pyrrol-1-yl)butan-1-one
Catalog ID
STL309511
SMILES COc1cc2CN(CCc2cc1OC)C(=O)CC(c1ccc(cc1)Cl)Cn1cccc1
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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 C25H27ClN2O3 MW 438.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27ClN2O3/c1-30-23-13-19-9-12-28(17-20(19)14-24(23)31-2)25(29)15-21(16-27-10-3-4-11-27)18-5-7-22(26)8-6-18/h3-8,10-11,13-14,21H,9,12,15-17H2,1-2H3InChIKey
BZHLXAAXVRWIPQ-UHFFFAOYSA-NSynonyms
1574480-43-51574480435
3(4chlorophenyl)1(67dimethoxy34dihydro1Hisoquinolin2yl)4pyrrol1ylbutan1one
3(4chlorophenyl)1(67dimethoxy34dihydroisoquinolin2(1H)yl)4(1Hpyrrol1yl)butan1one
COC1=C(C=C2CN(CCC2=C1)C(=O)CC(CN3C=CC=C3)C4=CC=C(C=C4)Cl)OC
InChI=1SC25H27ClN2O3c13023131991228(1720(19)1424(23)312)25(29)1521(162710341127)185722(26)8618h381011131421H9121517H212H3
MFCD28028968
ZINC000095472645
ZINC000095472646
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