Vitas-M small molecule compound
1-(azepan-1-yl)-2-(9-fluoro-5,5-dioxido-6H-dibenzo[c,e][1,2]thiazin-6-yl)ethanone
Catalog ID
STL116736
SMILES Fc1ccc2c(c1)c1ccccc1S(=O)(=O)N2CC(=O)N1CCCCCC1
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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 C20H21FN2O3S MW 388.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21FN2O3S/c21-15-9-10-18-17(13-15)16-7-3-4-8-19(16)27(25,26)23(18)14-20(24)22-11-5-1-2-6-12-22/h3-4,7-10,13H,1-2,5-6,11-12,14H2InChIKey
WCGBUUCWOMCKRG-UHFFFAOYSA-NSynonyms
1(azepan1yl)2(9fluoro55dioxido6Hdibenzo(ce)(12)thiazin6yl)ethanone
1(azepan1yl)2(9fluoro55dioxobenzo(c)(12)benzothiazin6yl)ethanone
C1CCCN(CC1)C(=O)CN2C3=C(C=C(C=C3)F)C4=CC=CC=C4S2(=O)=O
InChI=1SC20H21FN2O3Sc21159101817(1315)16734819(16)27(2526)23(18)1420(24)221151261222h3471013H1256111214H2
MFCD14856376
ZINC000024608037
ZINC24608037
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