Vitas-M small molecule compound
methyl 4-(4-bromophenyl)-7-fluoro-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide
Catalog ID
STL096078
SMILES COC(=O)C1=CN(c2ccc(cc2)Br)c2c(S1(=O)=O)cc(cc2)F
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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 C16H11BrFNO4S MW 412.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11BrFNO4S/c1-23-16(20)15-9-19(12-5-2-10(17)3-6-12)13-7-4-11(18)8-14(13)24(15,21)22/h2-9H,1H3InChIKey
CNBWDXNXXIIWQA-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C2=C(S1(=O)=O)C=C(C=C2)F)C3=CC=C(C=C3)Br
InChI=1SC16H11BrFNO4Sc12316(20)15919(125210(17)3612)137411(18)814(13)24(1521)22h29H1H3
methyl4(4bromophenyl)7fluoro11dioxo1$l^(6)4benzothiazine2carboxylate
methyl4(4bromophenyl)7fluoro4H14benzothiazine2carboxylate11dioxide
MFCD18788355
ZINC000064979248
ZINC64979248
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