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

Systemtic Name: 2-[[cyclohexyl(methyl)amino]methyl]-4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[cyclohexyl(methyl)amino]methyl]-4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[cyclohexyl(methyl)amino]methyl]-4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[[cyclohexyl(methyl)amino]methyl]-4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[cyclohexyl(methyl)amino]methyl]-4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C18H25N5S MolecularWeight: 343.4896

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Descriptors Computed from Structure

Canonical SMILES:

CN(CN1C(=S)N(C(=N1)C2=CC=NC=C2)C3CC3)C4CCCCC4

Isomeric SMILES

CN(CN1C(=S)N(C(=N1)C2=CC=NC=C2)C3CC3)C4CCCCC4

InChI

InChI=1S/C18H25N5S/c1-21(15-5-3-2-4-6-15)13-22-18(24)23(16-7-8-16)17(20-22)14-9-11-19-12-10-14/h9-12,15-16H,2-8,13H2,1H3