Vitas-M small molecule compound
2-[4-(1,1-dioxido-1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl 4-methoxybenzoate
Catalog ID
STL290905
SMILES COc1ccc(cc1)C(=O)OCCN1CCN(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 C21H23N3O5S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O5S/c1-28-17-8-6-16(7-9-17)21(25)29-15-14-23-10-12-24(13-11-23)20-18-4-2-3-5-19(18)30(26,27)22-20/h2-9H,10-15H2,1H3InChIKey
RMSMKJOSVRHTQV-UHFFFAOYSA-NSynonyms
2(4(11dioxido12benzothiazol3yl)piperazin1yl)ethyl4methoxybenzoate
2(4(11DIOXO12BENZOTHIAZOL3YL)PIPERAZIN1YL)ETHYL4METHOXYBENZOATE
COC1=CC=C(C=C1)C(=O)OCCN2CCN(CC2)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC21H23N3O5Sc128178616(7917)21(25)29151423101224(131123)2018423519(18)30(2627)2220h29H1015H21H3
MFCD03044680
ZINC000019927721
ZINC19927721
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