3-(4-methylphenyl)-N,2-diphenyl-1,2,4-thiadiazol-2-ium-5-amine

Systemtic Name: 3-(4-methylphenyl)-N,2-diphenyl-1,2,4-thiadiazol-2-ium-5-amine Openeye Name: N,2-diphenyl-3-(p-tolyl)-1,2,4-thiadiazol-2-ium-5-amine CAS Name: 3-(4-methylphenyl)-N,2-diphenyl-1,2,4-thiadiazol-2-ium-5-amine IUPAC Name: 3-(4-methylphenyl)-N,2-diphenyl-1,2,4-thiadiazol-2-ium-5-amine Traditional Name: phenyl-[2-phenyl-3-(p-tolyl)-1,2,4-thiadiazol-2-ium-5-yl]amine Formula: C21H18N3S+ MolecularWeight: 344.45272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=[N+](SC(=N2)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=[N+](SC(=N2)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3S/c1-16-12-14-17(15-13-16)20-23-21(22-18-8-4-2-5-9-18)25-24(20)19-10-6-3-7-11-19/h2-15H,1H3/p+1