Vitas-M small molecule compound
3-(2-bromophenoxy)-9-(1,1-dioxidotetrahydrothiophen-3-yl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one
Catalog ID
STL099306
SMILES Brc1ccccc1Oc1coc2c(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 C21H18BrNO6S MW 492.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrNO6S/c22-16-3-1-2-4-18(16)29-19-10-27-21-14(20(19)24)5-6-17-15(21)9-23(12-28-17)13-7-8-30(25,26)11-13/h1-6,10,13H,7-9,11-12H2InChIKey
JHJWLVXDMGQBRK-UHFFFAOYSA-NSynonyms
951953-21-23(2bromophenoxy)9(11dioxidotetrahydrothiophen3yl)910dihydro4H8Hchromeno(87e)(13)oxazin4one
3(2BROMOPHENOXY)9(11DIOXIDOTETRAHYDROTHIOPHEN3YL)910DIHYDROCHROMENO(87E)(13)OXAZIN4(8H)ONE
3(2bromophenoxy)9(11dioxothiolan3yl)810dihydropyrano(23f)(13)benzoxazin4one
3(3(2BROMOPHENOXY)4OXO8H10HCHROMENO(87E)13OXAZAPERHYDROIN9YL)THIOLANE11DIONE
951953212
C1CS(=O)(=O)CC1N2CC3=C(C=CC4=C3OC=C(C4=O)OC5=CC=CC=C5Br)OC2
InChI=1SC21H18BrNO6Sc2216312418(16)291910272114(20(19)24)561715(21)923(122817)137830(2526)1113h161013H791112H2
MFCD09858762
ZINC000013735374
ZINC000013735377
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