Vitas-M small molecule compound

(2Z)-8-[2-(4-methoxyphenyl)ethyl]-2-(pyridin-4-ylmethylidene)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one

Catalog ID
STK622387
SMILES COc1ccc(cc1)CCN1COc2c(C1)c1O/C(=C\c3ccncc3)/C(=O)c1cc2

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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 C25H22N2O4 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O4/c1-29-19-4-2-17(3-5-19)10-13-27-15-21-22(30-16-27)7-6-20-24(28)23(31-25(20)21)14-18-8-11-26-12-9-18/h2-9,11-12,14H,10,13,15-16H2,1H3/b23-14-
InChIKey
PDUUQWWFJLJIQF-UCQKPKSFSA-N
Synonyms
951972-62-6
(2Z)8(2(4methoxyphenyl)ethyl)2(pyridin4ylmethylidene)79dihydrofuro(23f)(13)benzoxazin3one
(2Z)8(2(4methoxyphenyl)ethyl)2(pyridin4ylmethylidene)89dihydro7Hfuro(23f)(13)benzoxazin3(2H)one
(Z)8(4methoxyphenethyl)2(pyridin4ylmethylene)89dihydro2Hbenzofuro(76e)(13)oxazin3(7H)one
951972626
COC1=CC=C(C=C1)CCN2CC3=C(C=CC4=C3OC(=CC5=CC=NC=C5)C4=O)OC2
COc1ccc(cc1)CCN1COc2c(C1)c1OC(=Cc3ccncc3)C(=O)c1cc2
InChI=1SC25H22N2O4c129194217(3519)101327152122(301627)762024(28)23(3125(20)21)14188112612918h29111214H10131516H21H3b2314
MFCD09858653
ZINC000013734974
ZINC13734974

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Available files

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