Vitas-M small molecule compound
3-(2,5-dimethylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide
Catalog ID
STK747079
SMILES Cc1ccc(c(c1)OC1=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 C15H12N2O5S MW 332.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N2O5S/c1-9-3-4-10(2)13(7-9)22-15-12-6-5-11(17(18)19)8-14(12)23(20,21)16-15/h3-8H,1-2H3InChIKey
NOKFUTFURWKNPJ-UHFFFAOYSA-NSynonyms
3(25DIMETHYLPHENOXY)6NITRO12BENZISOTHIAZOLE11DIOXIDE
3(25dimethylphenoxy)6nitro12benzothiazole11dioxide
CC1=CC(=C(C=C1)C)OC2=NS(=O)(=O)C3=C2C=CC(=C3)(N+)(=O)(O)
Cc1ccc(c(c1)OC1=NS(=O)(=O)c2c1ccc(c2)(N+)(=O)(O))C
InChI=1SC15H12N2O5Sc193410(2)13(79)2215126511(17(18)19)814(12)23(2021)1615h38H12H3
MFCD00490512
ZINC000004134281
ZINC04134281
ZINC4134281
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