Vitas-M small molecule compound
(2E)-1-(pyridin-4-yl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Catalog ID
STK584368
SMILES O=C(c1ccncc1)/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(13-2-5-20-6-3-13)12-16-15-11-19-18(23-8-1-9-24-19)10-14(15)4-7-21-16/h2-3,5-6,10-12,21H,1,4,7-9H2/b16-12+InChIKey
OTCXDUQJHNSLCF-FOWTUZBSSA-NSynonyms
904209-63-8(2E)1(pyridin4yl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
(2E)2(2348910hexahydro(14)dioxepino(23g)isoquinolin7ylidene)1pyridin4ylethanone
(E)1(pyridin4yl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
904209638
C1COC2=C(C=C3C(=C2)CCNC3=CC(=O)C4=CC=NC=C4)OC1
InChI=1SC19H18N2O3c2217(1325206313)121615111918(238192419)1014(15)472116h2356101221H1479H2b1612+
MFCD07638427
O=C(c1ccncc1)C=C1NCCc2c1cc1OCCCOc1c2
ZINC000101037243
ZINC101037243
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