Vitas-M small molecule compound
6-nitro-3-phenoxy-1,2-benzothiazole 1,1-dioxide
Catalog ID
STL287073
SMILES [O-][N+](=O)c1ccc2c(c1)S(=O)(=O)N=C2Oc1ccccc1
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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 C13H8N2O5S MW 304.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8N2O5S/c16-15(17)9-6-7-11-12(8-9)21(18,19)14-13(11)20-10-4-2-1-3-5-10/h1-8HInChIKey
KDQSEXIQWIVWLQ-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc2c(c1)S(=O)(=O)N=C2Oc1ccccc1
6nitro3phenoxy12benzothiazole11dioxide
C1=CC=C(C=C1)OC2=NS(=O)(=O)C3=C2C=CC(=C3)(N+)(=O)(O)
InChI=1SC13H8N2O5Sc1615(17)9671112(89)21(1819)1413(11)20104213510h18H
MFCD00486268
ZINC000005665062
ZINC5665062
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