Vitas-M small molecule compound

(2Z)-1-(pyridin-3-yl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone

Catalog ID
STK598629
SMILES O=C(c1cccnc1)/C=C/1\NCCc2c1cc1OCCCOc1c2

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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 C19H18N2O3 MW 322.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O3/c22-17(14-3-1-5-20-12-14)11-16-15-10-19-18(23-7-2-8-24-19)9-13(15)4-6-21-16/h1,3,5,9-12,21H,2,4,6-8H2/b16-11-
InChIKey
GOYVBRARPKDAJK-WJDWOHSUSA-N
Synonyms

(2Z)1(pyridin3yl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
(2Z)2(2348910hexahydro(14)dioxepino(23g)isoquinolin7ylidene)1pyridin3ylethanone
(E)1(pyridin3yl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
C1COC2=C(C=C3C(=C2)CCNC3=CC(=O)C4=CN=CC=C4)OC1
InChI=1SC19H18N2O3c2217(14315201214)111615101918(237282419)913(15)462116h13591221H2468H2b1611
MFCD07795238
O=C(c1cccnc1)C=C1NCCc2c1cc1OCCCOc1c2
ZINC000005389076
ZINC5389076

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Available files

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