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](2,4-dimethylphenyl)methanone
Catalog ID
STL095432
SMILES Fc1ccc2c(c1)N(C=C(S2(=O)=O)C(=O)c1ccc(cc1C)C)c1ccc2c(c1)OCCO2
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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 C25H20FNO5S MW 465.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FNO5S/c1-15-3-6-19(16(2)11-15)25(28)24-14-27(18-5-7-21-22(13-18)32-10-9-31-21)20-12-17(26)4-8-23(20)33(24,29)30/h3-8,11-14H,9-10H2,1-2H3InChIKey
MMLMLJSCDQSYKA-UHFFFAOYSA-NSynonyms
1114651-62-5(4(23dihydro14benzodioxin6yl)6fluoro11dioxido4H14benzothiazin2yl)(24dimethylphenyl)methanone
(4(23dihydro14benzodioxin6yl)6fluoro11dioxo1$l^(6)4benzothiazin2yl)(24dimethylphenyl)methanone
(4(23DIHYDROBENZO(B)(14)DIOXIN6YL)6FLUORO11DIOXIDO4HBENZO(B)(14)THIAZIN2YL)(24DIMETHYLPHENYL)METHANONE
1114651625
CC1=CC(=C(C=C1)C(=O)C2=CN(C3=C(S2(=O)=O)C=CC(=C3)F)C4=CC5=C(C=C4)OCCO5)C
InChI=1SC25H20FNO5Sc1153619(16(2)1115)25(28)241427(18572122(1318)321093121)201217(26)4823(20)33(2429)30h381114H910H212H3
MFCD14953558
ZINC000032984424
ZINC32984424
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