WN3

3-[bis(oxidanylidene)-$l^{5}-sulfanyl]-~{N}-pyridazin-3-yl-benzenesulfonamide

Created:2022-09-29
Last modified:  2025-04-09

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Chemical Details

Formal Charge0
Atom Count28
Chiral Atom Count0
Bond Count29
Aromatic Bond Count12
2D diagram of WN3

Chemical Component Summary

Name3-[bis(oxidanylidene)-$l^{5}-sulfanyl]-~{N}-pyridazin-3-yl-benzenesulfonamide
Systematic Name (OpenEye OEToolkits)3-hydrosulfonyl-~{N}-pyridazin-3-yl-benzenesulfonamide
FormulaC10 H9 N3 O4 S2
Molecular Weight299.326
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=S(=O)(Nc1cccnn1)c1cccc(c1)S(=O)=O
SMILESCACTVS3.385O=[SH](=O)c1cccc(c1)[S](=O)(=O)Nc2cccnn2
SMILESOpenEye OEToolkits2.0.7c1cc(cc(c1)S(=O)(=O)Nc2cccnn2)S(=O)=O
Canonical SMILESCACTVS3.385 O=[SH](=O)c1cccc(c1)[S](=O)(=O)Nc2cccnn2
Canonical SMILESOpenEye OEToolkits2.0.7 c1cc(cc(c1)S(=O)(=O)Nc2cccnn2)S(=O)=O
InChIInChI1.06 InChI=1S/C10H9N3O4S2/c14-18(15)8-3-1-4-9(7-8)19(16,17)13-10-5-2-6-11-12-10/h1-7,18H,(H,12,13)
InChIKeyInChI1.06 RPEIJACUMGJTIN-UHFFFAOYSA-N