Vitas-M small molecule compound
[4-(1,1-dioxido-1,2-benzothiazol-3-yl)piperazin-1-yl](3,4,5-trimethoxyphenyl)methanone
Catalog ID
STK130394
SMILES COc1cc(cc(c1OC)OC)C(=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 C21H23N3O6S MW 445.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O6S/c1-28-16-12-14(13-17(29-2)19(16)30-3)21(25)24-10-8-23(9-11-24)20-15-6-4-5-7-18(15)31(26,27)22-20/h4-7,12-13H,8-11H2,1-3H3InChIKey
REITUVNMPJANOT-UHFFFAOYSA-NSynonyms
(4(11DIOXIDO12BENZOTHIAZOL3YL)PIPERAZIN1YL)(345TRIMETHOXYPHENYL)METHANONE
(4(11DIOXO12BENZOTHIAZOL3YL)PIPERAZIN1YL)(345TRIMETHOXYPHENYL)METHANONE
COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC21H23N3O6Sc128161214(1317(292)19(16)303)21(25)2410823(91124)2015645718(15)31(2627)2220h471213H811H213H3
MFCD01617803
ZINC000000716559
ZINC00716559
ZINC716559
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