Vitas-M small molecule compound
1-(4-methoxybenzyl)-2,2-dioxido-1H-2,1-benzothiazin-4-yl 4-methylbenzenesulfonate
Catalog ID
STL081252
SMILES COc1ccc(cc1)CN1c2ccccc2C(=CS1(=O)=O)OS(=O)(=O)c1ccc(cc1)C
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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 C23H21NO6S2 MW 471.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO6S2/c1-17-7-13-20(14-8-17)32(27,28)30-23-16-31(25,26)24(22-6-4-3-5-21(22)23)15-18-9-11-19(29-2)12-10-18/h3-14,16H,15H2,1-2H3InChIKey
JXRKUYNSYDZZDH-UHFFFAOYSA-NSynonyms
(1((4methoxyphenyl)methyl)22dioxo2$l^(6)1benzothiazin4yl)4methylbenzenesulfonate
1(4methoxybenzyl)22dioxido1H21benzothiazin4yl4methylbenzenesulfonate
CC1=CC=C(C=C1)S(=O)(=O)OC2=CS(=O)(=O)N(C3=CC=CC=C32)CC4=CC=C(C=C4)OC
InChI=1SC23H21NO6S2c11771320(14817)32(2728)30231631(2526)24(22643521(22)23)151891119(292)121018h31416H15H212H3
MFCD18201673
ZINC000067225312
ZINC67225312
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