3-[(5-chloranyl-2-phenylsulfanyl-phenyl)amino]propyl-dimethyl-phenyl-azanium

Systemtic Name: 3-[(5-chloranyl-2-phenylsulfanyl-phenyl)amino]propyl-dimethyl-phenyl-azanium Openeye Name: 3-(5-chloro-2-phenylsulfanyl-anilino)propyl-dimethyl-phenyl-ammonium CAS Name: 3-[5-chloro-2-(phenylthio)anilino]propyl-dimethyl-phenylammonium IUPAC Name: 3-(5-chloro-2-phenylsulfanylanilino)propyl-dimethyl-phenylazanium Traditional Name: 3-[5-chloro-2-(phenylthio)anilino]propyl-dimethyl-phenyl-ammonium Formula: C23H26ClN2S+ MolecularWeight: 397.98394

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCNC1=C(C=CC(=C1)Cl)SC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[N+](C)(CCCNC1=C(C=CC(=C1)Cl)SC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H26ClN2S/c1-26(2,20-10-5-3-6-11-20)17-9-16-25-22-18-19(24)14-15-23(22)27-21-12-7-4-8-13-21/h3-8,10-15,18,25H,9,16-17H2,1-2H3/q+1