1-[(4-chlorophenyl)methyl]-3-[(4-fluorophenyl)methyl]-2-thiophen-2-yl-imidazolidine-1,3-diium

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-[(4-fluorophenyl)methyl]-2-thiophen-2-yl-imidazolidine-1,3-diium Openeye Name: 1-[(4-chlorophenyl)methyl]-3-[(4-fluorophenyl)methyl]-2-(2-thienyl)imidazolidine-1,3-diium CAS Name: 1-[(4-chlorophenyl)methyl]-3-[(4-fluorophenyl)methyl]-2-thiophen-2-ylimidazolidine-1,3-diium IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-[(4-fluorophenyl)methyl]-2-thiophen-2-ylimidazolidine-1,3-diium Traditional Name: 1-(4-chlorobenzyl)-3-(4-fluorobenzyl)-2-(2-thienyl)imidazolidine-1,3-diium Formula: C21H22ClFN2S+2 MolecularWeight: 388.929183

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C([NH+]1CC2=CC=C(C=C2)F)C3=CC=CS3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[NH+](C([NH+]1CC2=CC=C(C=C2)F)C3=CC=CS3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClFN2S/c22-18-7-3-16(4-8-18)14-24-11-12-25(21(24)20-2-1-13-26-20)15-17-5-9-19(23)10-6-17/h1-10,13,21H,11-12,14-15H2/p+2