Vitas-M small molecule compound
(2E)-1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(3-fluorophenyl)prop-2-en-1-one
Catalog ID
STK807242
SMILES Fc1cccc(c1)/C=C/C(=O)N1CCc2c(C1)cccc2
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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 C18H16FNO MW 281.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16FNO/c19-17-7-3-4-14(12-17)8-9-18(21)20-11-10-15-5-1-2-6-16(15)13-20/h1-9,12H,10-11,13H2/b9-8+InChIKey
SPSUCXYOGXGIJO-CMDGGOBGSA-NSynonyms
(2E)1(34dihydroisoquinolin2(1H)yl)3(3fluorophenyl)prop2en1one
(E)1(34DIHYDRO1HISOQUINOLIN2YL)3(3FLUOROPHENYL)PROP2EN1ONE
C1CN(CC2=CC=CC=C21)C(=O)C=CC3=CC(=CC=C3)F
Fc1cccc(c1)C=CC(=O)N1CCc2c(C1)cccc2
InChI=1SC18H16FNOc191773414(1217)8918(21)20111015512616(15)1320h1912H101113H2b98+
MFCD04439516
ZINC000004276246
ZINC04276246
ZINC4276246
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