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

Systemtic Name: 4-cyclopropyl-2-[(4-phenylmethoxypiperidin-1-ium-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 2-[(4-benzyloxypiperidin-1-ium-1-yl)methyl]-4-cyclopropyl-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-[(4-phenylmethoxy-1-piperidin-1-iumyl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-2-[(4-phenylmethoxypiperidin-1-ium-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 2-[(4-benzoxypiperidin-1-ium-1-yl)methyl]-4-cyclopropyl-1,2,4-triazole-3-thione Formula: C18H25N4OS+ MolecularWeight: 345.4823

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=NN(C2=S)C[NH+]3CCC(CC3)OCC4=CC=CC=C4

Isomeric SMILES

C1CC1N2C=NN(C2=S)C[NH+]3CCC(CC3)OCC4=CC=CC=C4

InChI

InChI=1S/C18H24N4OS/c24-18-21(16-6-7-16)13-19-22(18)14-20-10-8-17(9-11-20)23-12-15-4-2-1-3-5-15/h1-5,13,16-17H,6-12,14H2/p+1