5-(2,4-dichlorophenyl)-4-phenyl-N-(4-phenylphenyl)-1,3,4-thiadiazol-4-ium-2-amine

Systemtic Name: 5-(2,4-dichlorophenyl)-4-phenyl-N-(4-phenylphenyl)-1,3,4-thiadiazol-4-ium-2-amine Openeye Name: 5-(2,4-dichlorophenyl)-4-phenyl-N-(4-phenylphenyl)-1,3,4-thiadiazol-4-ium-2-amine CAS Name: 5-(2,4-dichlorophenyl)-4-phenyl-N-(4-phenylphenyl)-1,3,4-thiadiazol-4-ium-2-amine IUPAC Name: 5-(2,4-dichlorophenyl)-4-phenyl-N-(4-phenylphenyl)-1,3,4-thiadiazol-4-ium-2-amine Traditional Name: [5-(2,4-dichlorophenyl)-4-phenyl-1,3,4-thiadiazol-4-ium-2-yl]-(4-phenylphenyl)amine Formula: C26H18Cl2N3S+ MolecularWeight: 475.41222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)NC3=N[N+](=C(S3)C4=C(C=C(C=C4)Cl)Cl)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)NC3=N[N+](=C(S3)C4=C(C=C(C=C4)Cl)Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H18Cl2N3S/c27-20-13-16-23(24(28)17-20)25-31(22-9-5-2-6-10-22)30-26(32-25)29-21-14-11-19(12-15-21)18-7-3-1-4-8-18/h1-17H,(H,29,30)/q+1