1-ethyl-4-methyl-5-phenyl-2-[2,4,6-tris(chloranyl)phenyl]-1,2,4-triazol-4-ium-3-thione

Systemtic Name: 1-ethyl-4-methyl-5-phenyl-2-[2,4,6-tris(chloranyl)phenyl]-1,2,4-triazol-4-ium-3-thione Openeye Name: 1-ethyl-4-methyl-5-phenyl-2-(2,4,6-trichlorophenyl)-1,2,4-triazol-4-ium-3-thione CAS Name: 1-ethyl-4-methyl-5-phenyl-2-(2,4,6-trichlorophenyl)-1,2,4-triazol-4-ium-3-thione IUPAC Name: 1-ethyl-4-methyl-5-phenyl-2-(2,4,6-trichlorophenyl)-1,2,4-triazol-4-ium-3-thione Traditional Name: 1-ethyl-4-methyl-5-phenyl-2-(2,4,6-trichlorophenyl)-1,2,4-triazol-4-ium-3-thione Formula: C17H15Cl3N3S+ MolecularWeight: 399.7451

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+](C(=S)N1C2=C(C=C(C=C2Cl)Cl)Cl)C)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=[N+](C(=S)N1C2=C(C=C(C=C2Cl)Cl)Cl)C)C3=CC=CC=C3

InChI

InChI=1S/C17H15Cl3N3S/c1-3-22-16(11-7-5-4-6-8-11)21(2)17(24)23(22)15-13(19)9-12(18)10-14(15)20/h4-10H,3H2,1-2H3/q+1