2-(4-aminophenyl)carbonylsulfanylethyl-diethyl-azanium chloride

Systemtic Name: 2-(4-aminophenyl)carbonylsulfanylethyl-diethyl-azanium chloride Openeye Name: 2-(4-aminobenzoyl)sulfanylethyl-diethyl-ammonium chloride CAS Name: 2-[[(4-aminophenyl)-oxomethyl]thio]ethyl-diethylammonium chloride IUPAC Name: 2-(4-aminobenzoyl)sulfanylethyl-diethylazanium chloride Traditional Name: 2-[(4-aminobenzoyl)thio]ethyl-diethyl-ammonium chloride Formula: C13H21ClN2OS MolecularWeight: 288.83664

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCSC(=O)C1=CC=C(C=C1)N.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCSC(=O)C1=CC=C(C=C1)N.[Cl-]

InChI

InChI=1S/C13H20N2OS.ClH/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11;/h5-8H,3-4,9-10,14H2,1-2H3;1H