Vitas-M small molecule compound
4-chloro-2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl (3-methylphenoxy)acetate
Catalog ID
STL287648
SMILES O=C(Oc1ccc(cc1NC1=NS(=O)(=O)c2c1cccc2)Cl)COc1cccc(c1)C
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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 C22H17ClN2O5S MW 456.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN2O5S/c1-14-5-4-6-16(11-14)29-13-21(26)30-19-10-9-15(23)12-18(19)24-22-17-7-2-3-8-20(17)31(27,28)25-22/h2-12H,13H2,1H3,(H,24,25)InChIKey
RVRKLYWSOYINCN-UHFFFAOYSA-NSynonyms
(4CHLORO2((11DIOXO12BENZOTHIAZOL3YL)AMINO)PHENYL)2(3METHYLPHENOXY)ACETATE
4chloro2((11dioxido12benzothiazol3yl)amino)phenyl(3methylphenoxy)acetate
CC1=CC(=CC=C1)OCC(=O)OC2=C(C=C(C=C2)Cl)NC3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC22H17ClN2O5Sc11454616(1114)291321(26)301910915(23)1218(19)242217723820(17)31(2728)2522h212H13H21H3(H2425)
MFCD15093290
ZINC000003583332
ZINC3583332
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