4-(4-methoxyphenyl)-5-pyridin-4-yl-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-(4-methoxyphenyl)-5-pyridin-4-yl-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-(4-methoxyphenyl)-5-(4-pyridyl)-2-[[2-(3-pyridyl)pyrrolidin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-(4-methoxyphenyl)-5-pyridin-4-yl-2-[[2-(3-pyridinyl)-1-pyrrolidinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-(4-methoxyphenyl)-5-pyridin-4-yl-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-(4-methoxyphenyl)-5-(4-pyridyl)-2-[[2-(3-pyridyl)pyrrolidino]methyl]-1,2,4-triazole-3-thione Formula: C24H24N6OS MolecularWeight: 444.55196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN(C2=S)CN3CCCC3C4=CN=CC=C4)C5=CC=NC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN(C2=S)CN3CCCC3C4=CN=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C24H24N6OS/c1-31-21-8-6-20(7-9-21)30-23(18-10-13-25-14-11-18)27-29(24(30)32)17-28-15-3-5-22(28)19-4-2-12-26-16-19/h2,4,6-14,16,22H,3,5,15,17H2,1H3