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

Systemtic Name: 2-[[methyl-(phenylmethyl)amino]methyl]-4-(phenylmethyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-2-[[benzyl(methyl)amino]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[methyl-(phenylmethyl)amino]methyl]-4-(phenylmethyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-2-[[benzyl(methyl)amino]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-2-[[benzyl(methyl)amino]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C23H23N5S MolecularWeight: 401.52722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N5S/c1-26(16-19-8-4-2-5-9-19)18-28-23(29)27(17-20-10-6-3-7-11-20)22(25-28)21-12-14-24-15-13-21/h2-15H,16-18H2,1H3