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

Systemtic Name: 4-(2-methoxyphenyl)-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione Openeye Name: 4-(2-methoxyphenyl)-2-[[2-(3-pyridyl)pyrrolidin-1-yl]methyl]-5-(2-thienyl)-1,2,4-triazole-3-thione CAS Name: 4-(2-methoxyphenyl)-2-[[2-(3-pyridinyl)-1-pyrrolidinyl]methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione IUPAC Name: 4-(2-methoxyphenyl)-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione Traditional Name: 4-(2-methoxyphenyl)-2-[[2-(3-pyridyl)pyrrolidino]methyl]-5-(2-thienyl)-1,2,4-triazole-3-thione Formula: C23H23N5OS2 MolecularWeight: 449.59162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NN(C2=S)CN3CCCC3C4=CN=CC=C4)C5=CC=CS5

Isomeric SMILES

COC1=CC=CC=C1N2C(=NN(C2=S)CN3CCCC3C4=CN=CC=C4)C5=CC=CS5

InChI

InChI=1S/C23H23N5OS2/c1-29-20-10-3-2-8-19(20)28-22(21-11-6-14-31-21)25-27(23(28)30)16-26-13-5-9-18(26)17-7-4-12-24-15-17/h2-4,6-8,10-12,14-15,18H,5,9,13,16H2,1H3