Vitas-M small molecule compound
2-methyl-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-4-yl 2,2-dimethylpropanoate
Catalog ID
STL011991
SMILES O=C(C1=C(OC(=O)C(C)(C)C)c2ccccc2S(=O)(=O)N1C)c1ccccc1
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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 C21H21NO5S MW 399.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5S/c1-21(2,3)20(24)27-19-15-12-8-9-13-16(15)28(25,26)22(4)17(19)18(23)14-10-6-5-7-11-14/h5-13H,1-4H3InChIKey
RUTUENQFNPNUFQ-UHFFFAOYSA-NSynonyms
585558-84-5(3benzoyl2methyl11dioxo1$l^(6)2benzothiazin4yl)22dimethylpropanoate
2methyl11dioxido3(phenylcarbonyl)2H12benzothiazin4yl22dimethylpropanoate
3benzoyl2methyl11dioxido2Hbenzo(e)(12)thiazin4ylpivalate
585558845
CC(C)(C)C(=O)OC1=C(N(S(=O)(=O)C2=CC=CC=C21)C)C(=O)C3=CC=CC=C3
InChI=1SC21H21NO5Sc121(23)20(24)27191512891316(15)28(2526)22(4)17(19)18(23)14106571114h513H14H3
MFCD04030254
ZINC000004222985
ZINC04222985
ZINC4222985
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