Vitas-M small molecule compound
3-(2,3-dimethylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide
Catalog ID
STL287110
SMILES [O-][N+](=O)c1ccc2c(c1)S(=O)(=O)N=C2Oc1cccc(c1C)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 C15H12N2O5S MW 332.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N2O5S/c1-9-4-3-5-13(10(9)2)22-15-12-7-6-11(17(18)19)8-14(12)23(20,21)16-15/h3-8H,1-2H3InChIKey
XHNZWNSSGCFTPL-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc2c(c1)S(=O)(=O)N=C2Oc1cccc(c1C)C
3(23dimethylphenoxy)6nitro12benzothiazole11dioxide
CC1=C(C(=CC=C1)OC2=NS(=O)(=O)C3=C2C=CC(=C3)(N+)(=O)(O))C
InChI=1SC15H12N2O5Sc1943513(10(9)2)2215127611(17(18)19)814(12)23(2021)1615h38H12H3
MFCD24847398
ZINC000095481794
ZINC95481794
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