Vitas-M small molecule compound
2-{(3E,4E)-4-[(4-chlorophenyl)imino]-3-[hydroxy(phenyl)methylidene]-1,1-dioxido-3,4-dihydro-2H-1,2-benzothiazin-2-yl}-1-(4-nitrophenyl)ethanone
Catalog ID
STK561367
SMILES Clc1ccc(cc1)/N=C\1/C(=C(/c2ccccc2)\O)/N(CC(=O)c2ccc(cc2)[N+](=O)[O-])S(=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 C29H20ClN3O6S MW 574.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20ClN3O6S/c30-21-12-14-22(15-13-21)31-27-24-8-4-5-9-26(24)40(38,39)32(28(27)29(35)20-6-2-1-3-7-20)18-25(34)19-10-16-23(17-11-19)33(36)37/h1-17,35H,18H2/b29-28+,31-27+InChIKey
XBHYMMBHUCVBID-BHYVGNSXSA-NSynonyms
Clc1ccc(cc1)N=C1C(=C(c2ccccc2)O)N(CC(=O)c2ccc(cc2)(N+)(=O)(O))S(=O)(=O)c2c1cccc2
MFCD03813716
ZINC000102503407
Check stock
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Check stock on Vitas-MAvailable files
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