Vitas-M small molecule compound
3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]propyl 3-bromobenzoate
Catalog ID
STK138227
SMILES Brc1cccc(c1)C(=O)OCCCNC1=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 C17H15BrN2O4S MW 423.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN2O4S/c18-13-6-3-5-12(11-13)17(21)24-10-4-9-19-16-14-7-1-2-8-15(14)25(22,23)20-16/h1-3,5-8,11H,4,9-10H2,(H,19,20)InChIKey
REAOHFJMBRFQNJ-UHFFFAOYSA-NSynonyms
3((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)PROPYL3BROMOBENZOATE
3((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)PROPYL3BROMOBENZOATE
3((11DIOXO12BENZOTHIAZOL3YL)AMINO)PROPYL3BROMOBENZOATE
C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCOC(=O)C3=CC(=CC=C3)Br
InChI=1SC17H15BrN2O4Sc181363512(1113)17(21)241049191614712815(14)25(2223)2016h135811H4910H2(H1920)
MFCD03713408
ZINC000002812356
ZINC02812356
ZINC2812356
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