1-methyl-3-[(4-phenylpiperidin-1-ium-1-yl)methyl]benzimidazole-2-thione

Systemtic Name: 1-methyl-3-[(4-phenylpiperidin-1-ium-1-yl)methyl]benzimidazole-2-thione Openeye Name: 1-methyl-3-[(4-phenylpiperidin-1-ium-1-yl)methyl]benzimidazole-2-thione CAS Name: 1-methyl-3-[(4-phenyl-1-piperidin-1-iumyl)methyl]-2-benzimidazolethione IUPAC Name: 1-methyl-3-[(4-phenylpiperidin-1-ium-1-yl)methyl]benzimidazole-2-thione Traditional Name: 1-methyl-3-[(4-phenylpiperidin-1-ium-1-yl)methyl]benzimidazole-2-thione Formula: C20H24N3S+ MolecularWeight: 338.48966

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=S)C[NH+]3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=S)C[NH+]3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H23N3S/c1-21-18-9-5-6-10-19(18)23(20(21)24)15-22-13-11-17(12-14-22)16-7-3-2-4-8-16/h2-10,17H,11-15H2,1H3/p+1