Vitas-M small molecule compound

(2-chloro-6-fluorophenyl)(7-methylidene-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)methanone

Catalog ID
STK586438
SMILES C=C1c2cc3OCCCOc3cc2CCN1C(=O)c1c(F)cccc1Cl

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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 C20H17ClFNO3 MW 373.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClFNO3/c1-12-14-11-18-17(25-8-3-9-26-18)10-13(14)6-7-23(12)20(24)19-15(21)4-2-5-16(19)22/h2,4-5,10-11H,1,3,6-9H2
InChIKey
FXBNDDQKCVMGJS-UHFFFAOYSA-N
Synonyms
883953-78-4
(2chloro6fluorophenyl)(7methylene34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)methanone
(2chloro6fluorophenyl)(7methylidene34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)methanone
(2chloro6fluorophenyl)(7methylidene34910tetrahydro2H(14)dioxepino(23g)isoquinolin8yl)methanone
883953784
C=C1C2=CC3=C(C=C2CCN1C(=O)C4=C(C=CC=C4Cl)F)OCCCO3
InChI=1SC20H17ClFNO3c11214111817(258392618)1013(14)6723(12)20(24)1915(21)42516(19)22h2451011H1369H2
MFCD07638378
ZINC000005354770
ZINC05354770
ZINC5354770

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Available files

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