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

Systemtic Name: 4-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 4-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 4-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 4-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C18H21N5OS MolecularWeight: 355.45724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN(C)CCOC2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

CN1C(=NN(C1=S)CN(C)CCOC2=CC=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C18H21N5OS/c1-21(11-12-24-16-8-4-3-5-9-16)14-23-18(25)22(2)17(20-23)15-7-6-10-19-13-15/h3-10,13H,11-12,14H2,1-2H3