Vitas-M small molecule compound
(2,4-dimethoxyphenyl)[4-(1,1-dioxido-1,2-benzothiazol-3-yl)piperazin-1-yl]methanone
Catalog ID
STL287657
SMILES COc1cc(OC)ccc1C(=O)N1CCN(CC1)C1=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 C20H21N3O5S MW 415.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O5S/c1-27-14-7-8-15(17(13-14)28-2)20(24)23-11-9-22(10-12-23)19-16-5-3-4-6-18(16)29(25,26)21-19/h3-8,13H,9-12H2,1-2H3InChIKey
NMWYCIMESMELJW-UHFFFAOYSA-NSynonyms
(24dimethoxyphenyl)(4(11dioxido12benzothiazol3yl)piperazin1yl)methanone
(24DIMETHOXYPHENYL)(4(11DIOXO12BENZOTHIAZOL3YL)PIPERAZIN1YL)METHANONE
COC1=CC(=C(C=C1)C(=O)N2CCN(CC2)C3=NS(=O)(=O)C4=CC=CC=C43)OC
InChI=1SC20H21N3O5Sc127147815(17(1314)282)20(24)2311922(101223)1916534618(16)29(2526)2119h3813H912H212H3
MFCD02111484
ZINC000003583356
ZINC3583356
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