3-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1H-imidazole-2-thione

Systemtic Name: 3-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1H-imidazole-2-thione Openeye Name: 3-(1-benzylpiperidin-1-ium-4-yl)-1H-imidazole-2-thione CAS Name: 3-[1-(phenylmethyl)-4-piperidin-1-iumyl]-1H-imidazole-2-thione IUPAC Name: 3-(1-benzylpiperidin-1-ium-4-yl)-1H-imidazole-2-thione Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-imidazoline-2-thione Formula: C15H20N3S+ MolecularWeight: 274.4044

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C=CNC2=S)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1N2C=CNC2=S)CC3=CC=CC=C3

InChI

InChI=1S/C15H19N3S/c19-15-16-8-11-18(15)14-6-9-17(10-7-14)12-13-4-2-1-3-5-13/h1-5,8,11,14H,6-7,9-10,12H2,(H,16,19)/p+1