Vitas-M small molecule compound
3-(4-ethylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide
Catalog ID
STL287109
SMILES CCc1ccc(cc1)OC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-]
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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/c1-2-10-3-6-12(7-4-10)22-15-13-8-5-11(17(18)19)9-14(13)23(20,21)16-15/h3-9H,2H2,1H3InChIKey
VJXVBJFUXIZUON-UHFFFAOYSA-NSynonyms
3(4ethylphenoxy)6nitro12benzothiazole11dioxide
CCC1=CC=C(C=C1)OC2=NS(=O)(=O)C3=C2C=CC(=C3)(N+)(=O)(O)
CCc1ccc(cc1)OC1=NS(=O)(=O)c2c1ccc(c2)(N+)(=O)(O)
InChI=1SC15H12N2O5Sc12103612(7410)2215138511(17(18)19)914(13)23(2021)1615h39H2H21H3
MFCD24847397
ZINC000095481793
ZINC95481793
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