Vitas-M small molecule compound
(2Z)-8-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-methoxybenzylidene)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Catalog ID
STL099337
SMILES COc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)C1CCS(=O)(=O)C1
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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 C22H21NO6S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO6S/c1-27-16-4-2-14(3-5-16)10-20-21(24)17-6-7-19-18(22(17)29-20)11-23(13-28-19)15-8-9-30(25,26)12-15/h2-7,10,15H,8-9,11-13H2,1H3/b20-10-InChIKey
ZVWFYOKEQGEBOU-JMIUGGIZSA-NSynonyms
946293-71-6(2Z)8(11dioxidotetrahydrothiophen3yl)2(4methoxybenzylidene)89dihydro7Hfuro(23f)(13)benzoxazin3(2H)one
(2Z)8(11dioxothiolan3yl)2((4methoxyphenyl)methylidene)79dihydrofuro(23f)(13)benzoxazin3one
946293716
COC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C4=C(C=C3)OCN(C4)C5CCS(=O)(=O)C5
COc1ccc(cc1)C=C1Oc2c(C1=O)ccc1c2CN(CO1)C1CCS(=O)(=O)C1
InChI=1SC22H21NO6Sc127164214(3516)102021(24)17671918(22(17)2920)1123(132819)158930(2526)1215h271015H891113H21H3b2010
MFCD09986362
ZINC000012442588
ZINC000012442590
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