2-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-butyl-amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-butyl-amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[butyl-(1,1-dioxothiolan-3-yl)amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione CAS Name: 2-[[butyl-(1,1-dioxo-3-thiolanyl)amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[butyl-(1,1-dioxothiolan-3-yl)amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[butyl-(1,1-diketothiolan-3-yl)amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Formula: C17H24N4O2S2 MolecularWeight: 380.52806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CN1C(=S)N=C(N1)C2=CC=CC=C2)C3CCS(=O)(=O)C3

Isomeric SMILES

CCCCN(CN1C(=S)N=C(N1)C2=CC=CC=C2)C3CCS(=O)(=O)C3

InChI

InChI=1S/C17H24N4O2S2/c1-2-3-10-20(15-9-11-25(22,23)12-15)13-21-17(24)18-16(19-21)14-7-5-4-6-8-14/h4-8,15H,2-3,9-13H2,1H3,(H,18,19,24)