Vitas-M small molecule compound
(2E)-3-(3-bromophenyl)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)prop-2-en-1-one
Catalog ID
STK593159
SMILES COc1cc2CN(CCc2cc1OC)C(=O)/C=C/c1cccc(c1)Br
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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 C20H20BrNO3 MW 402.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrNO3/c1-24-18-11-15-8-9-22(13-16(15)12-19(18)25-2)20(23)7-6-14-4-3-5-17(21)10-14/h3-7,10-12H,8-9,13H2,1-2H3/b7-6+InChIKey
QJOLCUWMGDMKMN-VOTSOKGWSA-NSynonyms
771509-31-0(2E)3(3bromophenyl)1(67dimethoxy34dihydroisoquinolin2(1H)yl)prop2en1one
(E)3(3BROMOPHENYL)1(67DIMETHOXY34DIHYDRO1HISOQUINOLIN2YL)PROP2EN1ONE
(E)3(3bromophenyl)1(67dimethoxy34dihydroisoquinolin2(1H)yl)prop2en1one
771509310
COC1=C(C=C2CN(CCC2=C1)C(=O)C=CC3=CC(=CC=C3)Br)OC
COc1cc2CN(CCc2cc1OC)C(=O)C=Cc1cccc(c1)Br
InChI=1SC20H20BrNO3c1241811158922(1316(15)1219(18)252)20(23)761443517(21)1014h371012H8913H212H3b76+
MFCD04804565
ZINC000002433423
ZINC02433423
ZINC2433423
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