2-[[5-(diethylsulfamoyl)pyridin-1-ium-2-yl]-methyl-amino]-N-(2,5-dimethylphenyl)ethanamide

Systemtic Name: 2-[[5-(diethylsulfamoyl)pyridin-1-ium-2-yl]-methyl-amino]-N-(2,5-dimethylphenyl)ethanamide Openeye Name: 2-[[5-(diethylsulfamoyl)pyridin-1-ium-2-yl]-methyl-amino]-N-(2,5-dimethylphenyl)acetamide CAS Name: 2-[[5-(diethylsulfamoyl)-2-pyridin-1-iumyl]-methylamino]-N-(2,5-dimethylphenyl)acetamide IUPAC Name: 2-[[5-(diethylsulfamoyl)pyridin-1-ium-2-yl]-methylamino]-N-(2,5-dimethylphenyl)acetamide Traditional Name: 2-[[5-(diethylsulfamoyl)pyridin-1-ium-2-yl]-methyl-amino]-N-(2,5-dimethylphenyl)acetamide Formula: C20H29N4O3S+ MolecularWeight: 405.53426

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C[NH+]=C(C=C1)N(C)CC(=O)NC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C[NH+]=C(C=C1)N(C)CC(=O)NC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C20H28N4O3S/c1-6-24(7-2)28(26,27)17-10-11-19(21-13-17)23(5)14-20(25)22-18-12-15(3)8-9-16(18)4/h8-13H,6-7,14H2,1-5H3,(H,22,25)/p+1