Vitas-M small molecule compound
2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]ethyl (3-methylphenoxy)acetate
Catalog ID
STL287630
SMILES O=C(COc1cccc(c1)C)OCCNC1=NS(=O)(=O)c2c1cccc2
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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 C18H18N2O5S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O5S/c1-13-5-4-6-14(11-13)25-12-17(21)24-10-9-19-18-15-7-2-3-8-16(15)26(22,23)20-18/h2-8,11H,9-10,12H2,1H3,(H,19,20)InChIKey
WATYSQFZRFDDNT-UHFFFAOYSA-NSynonyms
2((11dioxido12benzothiazol3yl)amino)ethyl(3methylphenoxy)acetate
2((11dioxo12benzothiazol3yl)amino)ethyl2(3methylphenoxy)acetate
CC1=CC(=CC=C1)OCC(=O)OCCNC2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC18H18N2O5Sc11354614(1113)251217(21)24109191815723816(15)26(2223)2018h2811H91012H21H3(H1920)
MFCD24847763
ZINC000095481970
ZINC95481970
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