Vitas-M small molecule compound
(2Z)-5-methyl-2-(3-phenoxybenzylidene)-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
Catalog ID
STL177250
SMILES O=c1/c(=C/c2cccc(c2)Oc2ccccc2)/sc2=NC3(CC(n12)c1ccccc1O3)C
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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 C26H20N2O3S MW 440.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O3S/c1-26-16-21(20-12-5-6-13-22(20)31-26)28-24(29)23(32-25(28)27-26)15-17-8-7-11-19(14-17)30-18-9-3-2-4-10-18/h2-15,21H,16H2,1H3/b23-15-InChIKey
HMLHQROXSVVVKH-HAHDFKILSA-NSynonyms
832136-08-0(2Z)5methyl2(3phenoxybenzylidene)5H11H511methano(13)thiazolo(23d)(135)benzoxadiazocin1(2H)one
832136080
CC12CC(C3=CC=CC=C3O1)N4C(=O)C(=CC5=CC(=CC=C5)OC6=CC=CC=C6)SC4=N2
InChI=1SC26H20N2O3Sc1261621(2012561322(20)3126)2824(29)23(3225(28)2726)1517871119(1417)301893241018h21521H16H21H3b2315
MFCD04052499
O=c1c(=Cc2cccc(c2)Oc2ccccc2)sc2=NC3(CC(n12)c1ccccc1O3)C
ZINC000020608485
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