1-(2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-yl)-3-phenyl-thiourea chloride

Systemtic Name: 1-(2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-yl)-3-phenyl-thiourea chloride Openeye Name: 1-(2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-yl)-3-phenyl-thiourea chloride CAS Name: 1-(2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-yl)-3-phenylthiourea chloride IUPAC Name: 1-(2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-yl)-3-phenylthiourea chloride Traditional Name: 1-(2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-yl)-3-phenyl-thiourea chloride Formula: C21H17ClN4S2 MolecularWeight: 424.96948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[N+](SC(=N2)NC(=S)NC3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C2=[N+](SC(=N2)NC(=S)NC3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C21H16N4S2.ClH/c26-20(22-17-12-6-2-7-13-17)24-21-23-19(16-10-4-1-5-11-16)25(27-21)18-14-8-3-9-15-18;/h1-15H,(H,22,26);1H