N-cyclohexyl-2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-amine iodide

Systemtic Name: N-cyclohexyl-2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-amine iodide Openeye Name: N-cyclohexyl-2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-amine iodide CAS Name: N-cyclohexyl-2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-amine iodide IUPAC Name: N-cyclohexyl-2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-amine iodide Traditional Name: cyclohexyl-(2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-yl)amine iodide Formula: C20H22IN3S MolecularWeight: 463.37825

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=[N+](S2)C3=CC=CC=C3)C4=CC=CC=C4.[I-]

Isomeric SMILES

C1CCC(CC1)NC2=NC(=[N+](S2)C3=CC=CC=C3)C4=CC=CC=C4.[I-]

InChI

InChI=1S/C20H21N3S.HI/c1-4-10-16(11-5-1)19-22-20(21-17-12-6-2-7-13-17)24-23(19)18-14-8-3-9-15-18;/h1,3-5,8-11,14-15,17H,2,6-7,12-13H2;1H