2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-4-ium-1-yl]-N-(4-sulfamoylphenyl)ethanamide

Systemtic Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-4-ium-1-yl]-N-(4-sulfamoylphenyl)ethanamide Openeye Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-4-ium-1-yl]-N-(4-sulfamoylphenyl)acetamide CAS Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-4-ium-1-yl]-N-(4-sulfamoylphenyl)acetamide IUPAC Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-4-ium-1-yl]-N-(4-sulfamoylphenyl)acetamide Traditional Name: 2-[4-(4-fluorobenzyl)-1,4-diazepan-4-ium-1-yl]-N-(4-sulfamoylphenyl)acetamide Formula: C20H26FN4O3S+ MolecularWeight: 421.508843

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN(C1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)CC3=CC=C(C=C3)F

Isomeric SMILES

C1C[NH+](CCN(C1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H25FN4O3S/c21-17-4-2-16(3-5-17)14-24-10-1-11-25(13-12-24)15-20(26)23-18-6-8-19(9-7-18)29(22,27)28/h2-9H,1,10-15H2,(H,23,26)(H2,22,27,28)/p+1