3-[2-methyl-1-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)butyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[2-methyl-1-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)butyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[2-methyl-1-(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)butyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-methyl-1-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)butyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-methyl-1-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)butyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-methyl-1-(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)butyl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C21H22N6S2 MolecularWeight: 422.56958

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=NNC(=S)N1C2=CC=CC=C2)C3=NNC(=S)N3C4=CC=CC=C4

Isomeric SMILES

CCC(C)C(C1=NNC(=S)N1C2=CC=CC=C2)C3=NNC(=S)N3C4=CC=CC=C4

InChI

InChI=1S/C21H22N6S2/c1-3-14(2)17(18-22-24-20(28)26(18)15-10-6-4-7-11-15)19-23-25-21(29)27(19)16-12-8-5-9-13-16/h4-14,17H,3H2,1-2H3,(H,24,28)(H,25,29)