1-methyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]imidazole-2-thione

Systemtic Name: 1-methyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]imidazole-2-thione Openeye Name: 1-methyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]imidazole-2-thione CAS Name: 1-methyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-2-imidazolethione IUPAC Name: 1-methyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]imidazole-2-thione Traditional Name: 1-methyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-4-imidazoline-2-thione Formula: C16H20N3S+ MolecularWeight: 286.4151

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN(C1=S)C[NH+]2CCC(=CC2)C3=CC=CC=C3

Isomeric SMILES

CN1C=CN(C1=S)C[NH+]2CCC(=CC2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3S/c1-17-11-12-19(16(17)20)13-18-9-7-15(8-10-18)14-5-3-2-4-6-14/h2-7,11-12H,8-10,13H2,1H3/p+1