3-[[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[[[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-4-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[[[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-4-(4-methoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C26H24N6O3S2 MolecularWeight: 532.63716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C26H24N6O3S2/c1-33-20-12-10-19(11-13-20)31-23(27-29-25(31)36)16-37-26-30-28-24(32(26)18-7-5-4-6-8-18)17-9-14-21(34-2)22(15-17)35-3/h4-15H,16H2,1-3H3,(H,29,36)