Vitas-M small molecule compound
(2Z)-2-(pyridin-4-ylmethylidene)-8-(3,4,5-trimethoxybenzyl)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Catalog ID
STK628397
SMILES COc1cc(CN2COc3c(C2)c2O/C(=C\c4ccncc4)/C(=O)c2cc3)cc(c1OC)OC
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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 C26H24N2O6 MW 460.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O6/c1-30-22-11-17(12-23(31-2)26(22)32-3)13-28-14-19-20(33-15-28)5-4-18-24(29)21(34-25(18)19)10-16-6-8-27-9-7-16/h4-12H,13-15H2,1-3H3/b21-10-InChIKey
KHBMMFGYPHPCCN-FBHDLOMBSA-NSynonyms
951948-65-5(2Z)2(pyridin4ylmethylidene)8((345trimethoxyphenyl)methyl)79dihydrofuro(23f)(13)benzoxazin3one
(2Z)2(pyridin4ylmethylidene)8(345trimethoxybenzyl)89dihydro7Hfuro(23f)(13)benzoxazin3(2H)one
(Z)2(pyridin4ylmethylene)8(345trimethoxybenzyl)89dihydro2Hbenzofuro(76e)(13)oxazin3(7H)one
951948655
COC1=CC(=CC(=C1OC)OC)CN2CC3=C(C=CC4=C3OC(=CC5=CC=NC=C5)C4=O)OC2
COc1cc(CN2COc3c(C2)c2OC(=Cc4ccncc4)C(=O)c2cc3)cc(c1OC)OC
InChI=1SC26H24N2O6c130221117(1223(312)26(22)323)1328141920(331528)541824(29)21(3425(18)19)101668279716h412H1315H213H3b2110
MFCD09851470
ZINC000013690066
ZINC13690066
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