Vitas-M small molecule compound
methyl 4-(4-bromo-3-methylphenyl)-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide
Catalog ID
STL096034
SMILES COC(=O)C1=CN(c2ccc(c(c2)C)Br)c2c(S1(=O)=O)cccc2
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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 C17H14BrNO4S MW 408.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14BrNO4S/c1-11-9-12(7-8-13(11)18)19-10-16(17(20)23-2)24(21,22)15-6-4-3-5-14(15)19/h3-10H,1-2H3InChIKey
WIOAXADECGNWBO-UHFFFAOYSA-NSynonyms
1291844-03-51291844035
CC1=C(C=CC(=C1)N2C=C(S(=O)(=O)C3=CC=CC=C32)C(=O)OC)Br
InChI=1SC17H14BrNO4Sc111912(7813(11)18)191016(17(20)232)24(2122)15643514(15)19h310H12H3
methyl4(4bromo3methylphenyl)11dioxo1$l^(6)4benzothiazine2carboxylate
methyl4(4bromo3methylphenyl)4H14benzothiazine2carboxylate11dioxide
MFCD18788311
ZINC000064979166
ZINC64979166
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