Vitas-M small molecule compound
3-[(2E)-2-(4-methoxy-3-nitrobenzylidene)hydrazinyl]-1,2-benzothiazole 1,1-dioxide
Catalog ID
STL290906
SMILES COc1ccc(cc1[N+](=O)[O-])/C=N/NC1=NS(=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 C15H12N4O5S MW 360.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N4O5S/c1-24-13-7-6-10(8-12(13)19(20)21)9-16-17-15-11-4-2-3-5-14(11)25(22,23)18-15/h2-9H,1H3,(H,17,18)/b16-9+InChIKey
SQXSUBMONYGNDW-CXUHLZMHSA-NSynonyms
3((2E)2(4methoxy3nitrobenzylidene)hydrazinyl)12benzothiazole11dioxide
COC1=C(C=C(C=C1)C=NNC2=NS(=O)(=O)C3=CC=CC=C32)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C=NNC1=NS(=O)(=O)c2c1cccc2
InChI=1SC15H12N4O5Sc124137610(812(13)19(20)21)916171511423514(11)25(2223)1815h29H1H3(H1718)b169+
MFCD05040226
N((E)(4methoxy3nitrophenyl)methylideneamino)11dioxo12benzothiazol3amine
ZINC000095482139
ZINC101346975
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