1-[(3-ethyl-4-phenyl-2-sulfanylidene-imidazol-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-ethyl-4-phenyl-2-sulfanylidene-imidazol-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(3-ethyl-4-phenyl-2-thioxo-imidazol-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-ethyl-4-phenyl-2-sulfanylidene-1-imidazolyl)methyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3-ethyl-4-phenyl-2-sulfanylideneimidazol-1-yl)methyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(3-ethyl-4-phenyl-2-thioxo-4-imidazolin-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C24H29N4OS+ MolecularWeight: 421.57826

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN(C1=S)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=CN(C1=S)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4OS/c1-2-28-22(19-9-5-3-6-10-19)17-27(24(28)30)18-26-15-13-20(14-16-26)23(29)25-21-11-7-4-8-12-21/h3-12,17,20H,2,13-16,18H2,1H3,(H,25,29)/p+1