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

Systemtic Name: 2-[[cyclohexyl(ethyl)amino]methyl]-4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[cyclohexyl(ethyl)amino]methyl]-4-(p-tolyl)-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[cyclohexyl(ethyl)amino]methyl]-4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[[cyclohexyl(ethyl)amino]methyl]-4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[cyclohexyl(ethyl)amino]methyl]-4-(p-tolyl)-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C23H29N5S MolecularWeight: 407.57486

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CN1C(=S)N(C(=N1)C2=CC=NC=C2)C3=CC=C(C=C3)C)C4CCCCC4

Isomeric SMILES

CCN(CN1C(=S)N(C(=N1)C2=CC=NC=C2)C3=CC=C(C=C3)C)C4CCCCC4

InChI

InChI=1S/C23H29N5S/c1-3-26(20-7-5-4-6-8-20)17-27-23(29)28(21-11-9-18(2)10-12-21)22(25-27)19-13-15-24-16-14-19/h9-16,20H,3-8,17H2,1-2H3