Vitas-M small molecule compound
[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-fluoro-1,1-dioxido-4H-1,4-benzothiazin-2-yl](3,4-dimethoxyphenyl)methanone
Catalog ID
STL095486
SMILES COc1ccc(cc1OC)C(=O)C1=CN(c2ccc3c(c2)OCCO3)c2c(S1(=O)=O)ccc(c2)F
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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 C25H20FNO7S MW 497.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FNO7S/c1-31-19-6-3-15(11-21(19)32-2)25(28)24-14-27(17-5-7-20-22(13-17)34-10-9-33-20)18-12-16(26)4-8-23(18)35(24,29)30/h3-8,11-14H,9-10H2,1-2H3InChIKey
QBJOQNYBRJYLMR-UHFFFAOYSA-NSynonyms
1114872-66-0(4(23dihydro14benzodioxin6yl)6fluoro11dioxido4H14benzothiazin2yl)(34dimethoxyphenyl)methanone
(4(23dihydro14benzodioxin6yl)6fluoro11dioxo1$l^(6)4benzothiazin2yl)(34dimethoxyphenyl)methanone
(4(23DIHYDROBENZO(B)(14)DIOXIN6YL)6FLUORO11DIOXIDO4HBENZO(B)(14)THIAZIN2YL)(34DIMETHOXYPHENYL)METHANONE
1114872660
COC1=C(C=C(C=C1)C(=O)C2=CN(C3=C(S2(=O)=O)C=CC(=C3)F)C4=CC5=C(C=C4)OCCO5)OC
InChI=1SC25H20FNO7Sc131196315(1121(19)322)25(28)241427(17572022(1317)341093320)181216(26)4823(18)35(2429)30h381114H910H212H3
MFCD14953648
ZINC000032984514
ZINC32984514
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