Vitas-M small molecule compound
3-[(2E)-2-(5-bromo-2,3-dimethoxybenzylidene)-1-methylhydrazinyl]-6-nitro-1,2-benzothiazole 1,1-dioxide
Catalog ID
STK755405
SMILES COc1cc(Br)cc(c1OC)/C=N/N(C1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-])C
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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 C17H15BrN4O6S MW 483.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN4O6S/c1-21(19-9-10-6-11(18)7-14(27-2)16(10)28-3)17-13-5-4-12(22(23)24)8-15(13)29(25,26)20-17/h4-9H,1-3H3/b19-9+InChIKey
IVJGWYRGBBZQDE-DJKKODMXSA-NSynonyms
3((2E)2(5bromo23dimethoxybenzylidene)1methylhydrazinyl)6nitro12benzothiazole11dioxide
CN(C1=NS(=O)(=O)C2=C1C=CC(=C2)(N+)(=O)(O))N=CC3=CC(=CC(=C3OC)OC)Br
COc1cc(Br)cc(c1OC)C=NN(C1=NS(=O)(=O)c2c1ccc(c2)(N+)(=O)(O))C
InChI=1SC17H15BrN4O6Sc121(19910611(18)714(272)16(10)283)17135412(22(23)24)815(13)29(2526)2017h49H13H3b199+
MFCD00499444
N((E)(5BROMO23DIMETHOXYPHENYL)METHYLIDENEAMINO)NMETHYL6NITRO11DIOXO12BENZOTHIAZOL3AMINE
ZINC000015162466
ZINC102874335
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