5-(2,4-dichlorophenyl)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 5-(2,4-dichlorophenyl)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-1,2,4-triazole-3-thione Openeye Name: 5-(2,4-dichlorophenyl)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-1,2,4-triazole-3-thione CAS Name: 5-(2,4-dichlorophenyl)-2-[(4-methyl-1-piperidin-1-iumyl)methyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 5-(2,4-dichlorophenyl)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-1,2,4-triazole-3-thione Traditional Name: 5-(2,4-dichlorophenyl)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-1,2,4-triazole-3-thione Formula: C15H19Cl2N4S+ MolecularWeight: 358.30916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CN2C(=S)N=C(N2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1CC[NH+](CC1)CN2C(=S)N=C(N2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C15H18Cl2N4S/c1-10-4-6-20(7-5-10)9-21-15(22)18-14(19-21)12-3-2-11(16)8-13(12)17/h2-3,8,10H,4-7,9H2,1H3,(H,18,19,22)/p+1