Vitas-M small molecule compound
4-({[4-(acetylamino)phenyl]sulfonyl}oxy)-3-chloro-5-ethoxybenzoic acid
Catalog ID
STL426695
SMILES CCOc1cc(cc(c1OS(=O)(=O)c1ccc(cc1)NC(=O)C)Cl)C(=O)O
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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 C17H16ClNO7S MW 413.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClNO7S/c1-3-25-15-9-11(17(21)22)8-14(18)16(15)26-27(23,24)13-6-4-12(5-7-13)19-10(2)20/h4-9H,3H2,1-2H3,(H,19,20)(H,21,22)InChIKey
IJCYLQRSDWSSJH-UHFFFAOYSA-NSynonyms
4(((4(acetylamino)phenyl)sulfonyl)oxy)3chloro5ethoxybenzoicacid
4(4acetamidophenyl)sulfonyloxy3chloro5ethoxybenzoicacid
CCOC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC=C(C=C2)NC(=O)C
InChI=1SC17H16ClNO7Sc132515911(17(21)22)814(18)16(15)2627(2324)136412(5713)1910(2)20h49H3H212H3(H1920)(H2122)
MFCD29036241
ZINC000013463364
ZINC13463364
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