Vitas-M small molecule compound

4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl butanoate

Catalog ID
STK386993
SMILES CCCC(=O)Oc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)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 C18H18N2O4S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S/c1-3-6-17(21)24-14-11-9-13(10-12-14)20(2)18-15-7-4-5-8-16(15)25(22,23)19-18/h4-5,7-12H,3,6H2,1-2H3
InChIKey
WRCNOFBLDRRTDB-UHFFFAOYSA-N
Synonyms

(4((11DIOXO12BENZOTHIAZOL3YL)METHYLAMINO)PHENYL)BUTANOATE
4((11DIOXIDO12BENZOTHIAZOL3YL)(METHYL)AMINO)PHENYLBUTANOATE
4((11DIOXOBENZO(D)12THIAZOLIN3YL)METHYLAMINO)PHENYLBUTANOATE
CCCC(=O)OC1=CC=C(C=C1)N(C)C2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC18H18N2O4Sc13617(21)241411913(101214)20(2)1815745816(15)25(2223)1918h45712H36H212H3
MFCD01441301
ZINC000001461755
ZINC01461755
ZINC1461755

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Available files

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