Vitas-M small molecule compound
methyl 8-bromo-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxylate 5,5-dioxide
Catalog ID
STL133548
SMILES COC(=O)C1=C2CCCN2c2c(S1(=O)=O)ccc(c2)Br
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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 C13H12BrNO4S MW 358.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12BrNO4S/c1-19-13(16)12-9-3-2-6-15(9)10-7-8(14)4-5-11(10)20(12,17)18/h4-5,7H,2-3,6H2,1H3InChIKey
VXRGDRFAFXUIQI-UHFFFAOYSA-NSynonyms
COC(=O)C1=C2CCCN2C3=C(S1(=O)=O)C=CC(=C3)Br
InChI=1SC13H12BrNO4Sc11913(16)12932615(9)1078(14)4511(10)20(1217)18h457H236H21H3
methyl8bromo23dihydro1Hpyrrolo(21c)(14)benzothiazine4carboxylate55dioxide
methyl8bromo55dioxo23dihydro1Hpyrrolo(21c)(14)benzothiazine4carboxylate
MFCD20753738
ZINC000067340795
ZINC67340795
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