Vitas-M small molecule compound

9-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(4-methoxyphenoxy)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one

Catalog ID
STL099356
SMILES COc1ccc(cc1)Oc1coc2c(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 C22H21NO7S MW 443.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO7S/c1-27-15-2-4-16(5-3-15)30-20-11-28-22-17(21(20)24)6-7-19-18(22)10-23(13-29-19)14-8-9-31(25,26)12-14/h2-7,11,14H,8-10,12-13H2,1H3
InChIKey
XSEHWSJBBLOSLQ-UHFFFAOYSA-N
Synonyms
946235-91-2
3(3(4METHOXYPHENOXY)4OXO8H10HCHROMENO(87E)13OXAZAPERHYDROIN9YL)THIOLANE11DIONE
9(11dioxidotetrahydrothiophen3yl)3(4methoxyphenoxy)910dihydro4H8Hchromeno(87e)(13)oxazin4one
9(11DIOXIDOTETRAHYDROTHIOPHEN3YL)3(4METHOXYPHENOXY)910DIHYDROCHROMENO(87E)(13)OXAZIN4(8H)ONE
9(11dioxothiolan3yl)3(4methoxyphenoxy)810dihydropyrano(23f)(13)benzoxazin4one
946235912
COC1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC4=C3CN(CO4)C5CCS(=O)(=O)C5
InChI=1SC22H21NO7Sc127152416(5315)302011282217(21(20)24)671918(22)1023(132919)148931(2526)1214h271114H8101213H21H3
MFCD09986351
ZINC000012442558
ZINC000012442559

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Available files

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