[anthracen-9-ylmethylsulfanyl(phenylazanyl)methylidene]-phenyl-azanium chloride

Systemtic Name: [anthracen-9-ylmethylsulfanyl(phenylazanyl)methylidene]-phenyl-azanium chloride Openeye Name: [anilino(9-anthrylmethylsulfanyl)methylene]-phenyl-ammonium chloride CAS Name: [anilino-(9-anthracenylmethylthio)methylidene]-phenylammonium chloride IUPAC Name: [anilino(anthracen-9-ylmethylsulfanyl)methylidene]-phenylazanium chloride Traditional Name: [anilino-(9-anthrylmethylthio)methylene]-phenyl-ammonium chloride Formula: C28H23ClN2S MolecularWeight: 455.01362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=[NH+]C2=CC=CC=C2)SCC3=C4C=CC=CC4=CC5=CC=CC=C53.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=[NH+]C2=CC=CC=C2)SCC3=C4C=CC=CC4=CC5=CC=CC=C53.[Cl-]

InChI

InChI=1S/C28H22N2S.ClH/c1-3-13-23(14-4-1)29-28(30-24-15-5-2-6-16-24)31-20-27-25-17-9-7-11-21(25)19-22-12-8-10-18-26(22)27;/h1-19H,20H2,(H,29,30);1H