Vitas-M small molecule compound
2-[(2E)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-(4-nitrobenzylidene)hydrazinyl]ethanol
Catalog ID
STK324980
SMILES OCCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1ccc(cc1)[N+](=O)[O-]
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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 C16H14N4O5S MW 374.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O5S/c21-10-9-19(17-11-12-5-7-13(8-6-12)20(22)23)16-14-3-1-2-4-15(14)26(24,25)18-16/h1-8,11,21H,9-10H2/b17-11+InChIKey
ADAAQZVLVRFNKJ-GZTJUZNOSA-NSynonyms
2((11dioxo12benzothiazol3yl)((E)(4nitrophenyl)methylideneamino)amino)ethanol
2((2E)1(11dioxido12benzothiazol3yl)2(4nitrobenzylidene)hydrazinyl)ethanol
C1=CC=C2C(=C1)C(=NS2(=O)=O)N(CCO)N=CC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC16H14N4O5Sc2110919(1711125713(8612)20(22)23)1614312415(14)26(2425)1816h181121H910H2b1711+
MFCD01785578
OCCN(C1=NS(=O)(=O)c2c1cccc2)N=Cc1ccc(cc1)(N+)(=O)(O)
ZINC000005776132
ZINC34704203
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