N-[[5-[[6-(diethylamino)pyridin-1-ium-3-yl]methylsulfamoyl]thiophen-2-yl]methyl]ethanamide

Systemtic Name: N-[[5-[[6-(diethylamino)pyridin-1-ium-3-yl]methylsulfamoyl]thiophen-2-yl]methyl]ethanamide Openeye Name: N-[[5-[[6-(diethylamino)pyridin-1-ium-3-yl]methylsulfamoyl]-2-thienyl]methyl]acetamide CAS Name: N-[[5-[[6-(diethylamino)-3-pyridin-1-iumyl]methylsulfamoyl]-2-thiophenyl]methyl]acetamide IUPAC Name: N-[[5-[[6-(diethylamino)pyridin-1-ium-3-yl]methylsulfamoyl]thiophen-2-yl]methyl]acetamide Traditional Name: N-[[5-[[6-(diethylamino)pyridin-1-ium-3-yl]methylsulfamoyl]-2-thienyl]methyl]acetamide Formula: C17H25N4O3S2+ MolecularWeight: 397.5354

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=[NH+]C=C(C=C1)CNS(=O)(=O)C2=CC=C(S2)CNC(=O)C

Isomeric SMILES

CCN(CC)C1=[NH+]C=C(C=C1)CNS(=O)(=O)C2=CC=C(S2)CNC(=O)C

InChI

InChI=1S/C17H24N4O3S2/c1-4-21(5-2)16-8-6-14(10-19-16)11-20-26(23,24)17-9-7-15(25-17)12-18-13(3)22/h6-10,20H,4-5,11-12H2,1-3H3,(H,18,22)/p+1