Vitas-M small molecule compound
(7-methylidene-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)[2-(trifluoromethyl)phenyl]methanone
Catalog ID
STK575412
SMILES C=C1c2cc3OCCCOc3cc2CCN1C(=O)c1ccccc1C(F)(F)F
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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 C21H18F3NO3 MW 389.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3NO3/c1-13-16-12-19-18(27-9-4-10-28-19)11-14(16)7-8-25(13)20(26)15-5-2-3-6-17(15)21(22,23)24/h2-3,5-6,11-12H,1,4,7-10H2InChIKey
WTYOCYDYUCSUBF-UHFFFAOYSA-NSynonyms
879566-55-9(7methylene34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)(2(trifluoromethyl)phenyl)methanone
(7methylidene34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)(2(trifluoromethyl)phenyl)methanone
(7methylidene34910tetrahydro2H(14)dioxepino(23g)isoquinolin8yl)(2(trifluoromethyl)phenyl)methanone
879566559
C=C1C2=CC3=C(C=C2CCN1C(=O)C4=CC=CC=C4C(F)(F)F)OCCCO3
InChI=1SC21H18F3NO3c11316121918(2794102819)1114(16)7825(13)20(26)15523617(15)21(2223)24h23561112H14710H2
MFCD07639800
ZINC000005428593
ZINC05428593
ZINC5428593
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