Vitas-M small molecule compound
[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,1-dioxido-4H-1,4-benzothiazin-2-yl](pyrrolidin-1-yl)methanone
Catalog ID
STL097084
SMILES O=C(C1=CN(c2ccc3c(c2)OCCO3)c2c(S1(=O)=O)cccc2)N1CCCC1
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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 C21H20N2O5S MW 412.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O5S/c24-21(22-9-3-4-10-22)20-14-23(16-5-1-2-6-19(16)29(20,25)26)15-7-8-17-18(13-15)28-12-11-27-17/h1-2,5-8,13-14H,3-4,9-12H2InChIKey
PFXWCKGSCWMECX-UHFFFAOYSA-NSynonyms
1207005-99-9(4(23dihydro14benzodioxin6yl)11dioxido4H14benzothiazin2yl)(pyrrolidin1yl)methanone
(4(23dihydro14benzodioxin6yl)11dioxo1$l^(6)4benzothiazin2yl)pyrrolidin1ylmethanone
(4(23DIHYDROBENZO(B)(14)DIOXIN6YL)11DIOXIDO4HBENZO(B)(14)THIAZIN2YL)(PYRROLIDIN1YL)METHANONE
1207005999
4(23DIHYDRO14BENZODIOXIN6YL)2(PYRROLIDIN1YLCARBONYL)4H14BENZOTHIAZINE11DIOXIDE
C1CCN(C1)C(=O)C2=CN(C3=CC=CC=C3S2(=O)=O)C4=CC5=C(C=C4)OCCO5
InChI=1SC21H20N2O5Sc2421(229341022)201423(16512619(16)29(2025)26)15781718(1315)2812112717h12581314H34912H2
MFCD16640326
ZINC000038655249
ZINC38655249
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