4-cyclopropyl-2-[[2-(4-methoxyphenoxy)ethyl-methyl-amino]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-cyclopropyl-2-[[2-(4-methoxyphenoxy)ethyl-methyl-amino]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-2-[[2-(4-methoxyphenoxy)ethyl-methyl-amino]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-[[2-(4-methoxyphenoxy)ethyl-methylamino]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-2-[[2-(4-methoxyphenoxy)ethyl-methylamino]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-2-[[2-(4-methoxyphenoxy)ethyl-methyl-amino]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)OC)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4CC4

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)OC)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4CC4

InChI

InChI=1S/C21H25N5O2S/c1-24(13-14-28-19-7-5-18(27-2)6-8-19)15-25-21(29)26(17-3-4-17)20(23-25)16-9-11-22-12-10-16/h5-12,17H,3-4,13-15H2,1-2H3