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

Systemtic Name: [2-[[(4-bromanylthiophen-2-yl)methylazaniumyl]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [2-[[(4-bromo-2-thienyl)methylammonio]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [2-[[(4-bromo-2-thiophenyl)methylammonio]methyl]phenyl]methyl-diethylammonium IUPAC Name: [2-[[(4-bromothiophen-2-yl)methylazaniumyl]methyl]phenyl]methyl-diethylazanium Traditional Name: [2-[[(4-bromo-2-thienyl)methylammonio]methyl]benzyl]-diethyl-ammonium Formula: C17H25BrN2S+2 MolecularWeight: 369.3628

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1C[NH2+]CC2=CC(=CS2)Br

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1C[NH2+]CC2=CC(=CS2)Br

InChI

InChI=1S/C17H23BrN2S/c1-3-20(4-2)12-15-8-6-5-7-14(15)10-19-11-17-9-16(18)13-21-17/h5-9,13,19H,3-4,10-12H2,1-2H3/p+2