Vitas-M small molecule compound
2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]ethyl 2,4-dimethylbenzenesulfonate
Catalog ID
STK672156
SMILES Cc1ccc(c(c1)C)S(=O)(=O)OCCNC1=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 C17H18N2O5S2 MW 394.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O5S2/c1-12-7-8-15(13(2)11-12)26(22,23)24-10-9-18-17-14-5-3-4-6-16(14)25(20,21)19-17/h3-8,11H,9-10H2,1-2H3,(H,18,19)InChIKey
XNHDJDOCBPFSJU-UHFFFAOYSA-NSynonyms
2((11dioxido12benzothiazol3yl)amino)ethyl24dimethylbenzenesulfonate
2((11DIOXO12BENZOTHIAZOL3YL)AMINO)ETHYL24DIMETHYLBENZENESULFONATE
CC1=CC(=C(C=C1)S(=O)(=O)OCCNC2=NS(=O)(=O)C3=CC=CC=C32)C
InChI=1SC17H18N2O5S2c1127815(13(2)1112)26(2223)24109181714534616(14)25(2021)1917h3811H910H212H3(H1819)
MFCD00469507
ZINC000003661693
ZINC03661693
ZINC3661693
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