Vitas-M small molecule compound
2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl 3,5-dimethoxybenzoate
Catalog ID
STL287638
SMILES COc1cc(OC)cc(c1)C(=O)Oc1ccccc1NC1=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 C22H18N2O6S MW 438.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O6S/c1-28-15-11-14(12-16(13-15)29-2)22(25)30-19-9-5-4-8-18(19)23-21-17-7-3-6-10-20(17)31(26,27)24-21/h3-13H,1-2H3,(H,23,24)InChIKey
BKAWGXJLYNFTKT-UHFFFAOYSA-NSynonyms
(2((11DIOXO12BENZOTHIAZOL3YL)AMINO)PHENYL)35DIMETHOXYBENZOATE
2((11dioxido12benzothiazol3yl)amino)phenyl35dimethoxybenzoate
COC1=CC(=CC(=C1)C(=O)OC2=CC=CC=C2NC3=NS(=O)(=O)C4=CC=CC=C43)OC
InChI=1SC22H18N2O6Sc128151114(1216(1315)292)22(25)3019954818(19)2321177361020(17)31(2627)2421h313H12H3(H2324)
MFCD02112674
ZINC000003583300
ZINC3583300
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