5-[N-(4-methylphenyl)-C-phenyl-carbonimidoyl]-3,4-diphenyl-4,5-dihydro-1,3-thiazol-3-ium-2-amine chloride

Systemtic Name: 5-[N-(4-methylphenyl)-C-phenyl-carbonimidoyl]-3,4-diphenyl-4,5-dihydro-1,3-thiazol-3-ium-2-amine chloride Openeye Name: 3,4-diphenyl-5-[C-phenyl-N-(p-tolyl)carbonimidoyl]-4,5-dihydrothiazol-3-ium-2-amine chloride CAS Name: 5-[(4-methylphenyl)imino-phenylmethyl]-3,4-diphenyl-4,5-dihydrothiazol-3-ium-2-amine chloride IUPAC Name: 5-[N-(4-methylphenyl)-C-phenylcarbonimidoyl]-3,4-diphenyl-4,5-dihydro-1,3-thiazol-3-ium-2-amine chloride Traditional Name: [3,4-diphenyl-5-[C-phenyl-N-(p-tolyl)carbonimidoyl]-2-thiazolin-3-ium-2-yl]amine chloride Formula: C29H26ClN3S MolecularWeight: 484.05484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C(C2C([N+](=C(S2)N)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)N=C(C2C([N+](=C(S2)N)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C29H25N3S.ClH/c1-21-17-19-24(20-18-21)31-26(22-11-5-2-6-12-22)28-27(23-13-7-3-8-14-23)32(29(30)33-28)25-15-9-4-10-16-25;/h2-20,27-28,30H,1H3;1H