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

Systemtic Name: 2-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-[(4-methylpiperidin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 2-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-[(4-methyl-1-piperidyl)methyl]-1,2,4-triazole-3-thione CAS Name: 2-[(4-methyl-1-piperidin-1-iumyl)methyl]-4-[(4-methyl-1-piperidinyl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-[(4-methylpiperidin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 2-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-[(4-methylpiperidino)methyl]-1,2,4-triazole-3-thione Formula: C16H30N5S+ MolecularWeight: 324.5079

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CN2C(=S)N(C=N2)CN3CCC(CC3)C

Isomeric SMILES

CC1CC[NH+](CC1)CN2C(=S)N(C=N2)CN3CCC(CC3)C

InChI

InChI=1S/C16H29N5S/c1-14-3-7-18(8-4-14)12-20-11-17-21(16(20)22)13-19-9-5-15(2)6-10-19/h11,14-15H,3-10,12-13H2,1-2H3/p+1