Vitas-M small molecule compound
(2E)-1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Catalog ID
STK046382
SMILES COc1cc(/C=C/C(=O)N2CCc3c(C2)cccc3)cc(c1OC)OC
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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 C21H23NO4 MW 353.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO4/c1-24-18-12-15(13-19(25-2)21(18)26-3)8-9-20(23)22-11-10-16-6-4-5-7-17(16)14-22/h4-9,12-13H,10-11,14H2,1-3H3/b9-8+InChIKey
NQUCNDUILYDYCH-CMDGGOBGSA-NSynonyms
431995-30-1(2E)1(34DIHYDROISOQUINOLIN2(1H)YL)3(345TRIMETHOXYPHENYL)PROP2EN1ONE
(E)1(34DIHYDRO1HISOQUINOLIN2YL)3(345TRIMETHOXYPHENYL)PROP2EN1ONE
431995301
COC1=CC(=CC(=C1OC)OC)C=CC(=O)N2CCC3=CC=CC=C3C2
COc1cc(C=CC(=O)N2CCc3c(C2)cccc3)cc(c1OC)OC
InChI=1SC21H23NO4c124181215(1319(252)21(18)263)8920(23)22111016645717(16)1422h491213H101114H213H3b98+
MFCD03405637
STK046382
ZINC000001147519
ZINC01147519
ZINC1147519
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