[4-[[(5-bromanylthiophen-2-yl)sulfonylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[(5-bromanylthiophen-2-yl)sulfonylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[(5-bromo-2-thienyl)sulfonylamino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[(5-bromo-2-thiophenyl)sulfonylamino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[(5-bromothiophen-2-yl)sulfonylamino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[(5-bromo-2-thienyl)sulfonylamino]methyl]benzyl]-diethyl-ammonium Formula: C16H22BrN2O2S2+ MolecularWeight: 418.39208

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNS(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNS(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C16H21BrN2O2S2/c1-3-19(4-2)12-14-7-5-13(6-8-14)11-18-23(20,21)16-10-9-15(17)22-16/h5-10,18H,3-4,11-12H2,1-2H3/p+1