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

Systemtic Name: 4-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione Openeye Name: 4-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione CAS Name: 4-methyl-2-[(4-methyl-1-piperidin-1-iumyl)methyl]-5-phenyl-1,2,4-triazole-3-thione IUPAC Name: 4-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione Traditional Name: 4-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione Formula: C16H23N4S+ MolecularWeight: 303.44562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4S/c1-13-8-10-19(11-9-13)12-20-16(21)18(2)15(17-20)14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3/p+1