Vitas-M small molecule compound
ethyl 4-({[5,5-dioxido-6-(prop-2-en-1-yl)-6H-dibenzo[c,e][1,2]thiazin-9-yl]carbonyl}amino)benzoate
Catalog ID
STL385967
SMILES C=CCN1c2ccc(cc2c2c(S1(=O)=O)cccc2)C(=O)Nc1ccc(cc1)C(=O)OCC
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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 C25H22N2O5S MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O5S/c1-3-15-27-22-14-11-18(16-21(22)20-7-5-6-8-23(20)33(27,30)31)24(28)26-19-12-9-17(10-13-19)25(29)32-4-2/h3,5-14,16H,1,4,15H2,2H3,(H,26,28)InChIKey
VIGYTRSZRMZLAJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(S(=O)(=O)C4=CC=CC=C43)CC=C
ethyl4(((55dioxido6(prop2en1yl)6Hdibenzo(ce)(12)thiazin9yl)carbonyl)amino)benzoate
ethyl4((55dioxo6prop2enylbenzo(c)(12)benzothiazine9carbonyl)amino)benzoate
InChI=1SC25H22N2O5Sc13152722141118(1621(22)20756823(20)33(2730)31)24(28)261912917(101319)25(29)3242h351416H1415H22H3(H2628)
MFCD27225066
ZINC000033271899
ZINC33271899
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