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

Systemtic Name: 2-[[ethyl-(phenylmethyl)amino]methyl]-4-(phenylmethyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-2-[[benzyl(ethyl)amino]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[ethyl-(phenylmethyl)amino]methyl]-4-(phenylmethyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-2-[[benzyl(ethyl)amino]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-2-[[benzyl(ethyl)amino]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C24H25N5S MolecularWeight: 415.5538

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC1=CC=CC=C1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H25N5S/c1-2-27(17-20-9-5-3-6-10-20)19-29-24(30)28(18-21-11-7-4-8-12-21)23(26-29)22-13-15-25-16-14-22/h3-16H,2,17-19H2,1H3