diethyl-[[2-[[[4-(thiophen-2-ylsulfonylamino)phenyl]carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[2-[[[4-(thiophen-2-ylsulfonylamino)phenyl]carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[2-[[[4-(2-thienylsulfonylamino)benzoyl]amino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[2-[[[oxo-[4-(thiophen-2-ylsulfonylamino)phenyl]methyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[2-[[[4-(thiophen-2-ylsulfonylamino)benzoyl]amino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[2-[[[4-(2-thienylsulfonylamino)benzoyl]amino]methyl]benzyl]ammonium Formula: C23H28N3O3S2+ MolecularWeight: 458.61672

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C23H27N3O3S2/c1-3-26(4-2)17-20-9-6-5-8-19(20)16-24-23(27)18-11-13-21(14-12-18)25-31(28,29)22-10-7-15-30-22/h5-15,25H,3-4,16-17H2,1-2H3,(H,24,27)/p+1