Vitas-M small molecule compound
N-(2-butoxyethyl)-6-nitro-1,2-benzothiazol-3-amine 1,1-dioxide
Catalog ID
STL287103
SMILES CCCCOCCNC1=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 C13H17N3O5S MW 327.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O5S/c1-2-3-7-21-8-6-14-13-11-5-4-10(16(17)18)9-12(11)22(19,20)15-13/h4-5,9H,2-3,6-8H2,1H3,(H,14,15)InChIKey
DWZWUKGXLJHFNC-UHFFFAOYSA-NSynonyms
CCCCOCCNC1=NS(=O)(=O)C2=C1C=CC(=C2)(N+)(=O)(O)
CCCCOCCNC1=NS(=O)(=O)c2c1ccc(c2)(N+)(=O)(O)
InChI=1SC13H17N3O5Sc123721861413115410(16(17)18)912(11)22(1920)1513h459H2368H21H3(H1415)
MFCD02644878
N(2butoxyethyl)6nitro11dioxo12benzothiazol3amine
N(2butoxyethyl)6nitro12benzothiazol3amine11dioxide
ZINC000095481789
ZINC95481789
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