Vitas-M small molecule compound
4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methoxybenzyl)amino]phenyl phenoxyacetate
Catalog ID
STL287279
SMILES COc1ccc(cc1)CN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)OC(=O)COc1ccccc1
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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 C29H24N2O6S MW 528.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N2O6S/c1-35-23-15-11-21(12-16-23)19-31(29-26-9-5-6-10-27(26)38(33,34)30-29)22-13-17-25(18-14-22)37-28(32)20-36-24-7-3-2-4-8-24/h2-18H,19-20H2,1H3InChIKey
LBFHUBGOGBHYBA-UHFFFAOYSA-NSynonyms
(4((11dioxo12benzothiazol3yl)((4methoxyphenyl)methyl)amino)phenyl)2phenoxyacetate
4((11dioxido12benzothiazol3yl)(4methoxybenzyl)amino)phenylphenoxyacetate
COC1=CC=C(C=C1)CN(C2=CC=C(C=C2)OC(=O)COC3=CC=CC=C3)C4=NS(=O)(=O)C5=CC=CC=C54
InChI=1SC29H24N2O6Sc13523151121(121623)1931(29269561027(26)38(3334)3029)22131725(181422)3728(32)2036247324824h218H1920H21H3
MFCD24847482
ZINC000097971306
ZINC97971306
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