4-[(3-chlorophenyl)methyl]-N-(4-fluorophenyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-[(3-chlorophenyl)methyl]-N-(4-fluorophenyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-[(3-chlorophenyl)methyl]-N-(4-fluorophenyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-[(3-chlorophenyl)methyl]-N-(4-fluorophenyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-[(3-chlorophenyl)methyl]-N-(4-fluorophenyl)piperazin-4-ium-1-carbothioamide Traditional Name: 4-(3-chlorobenzyl)-N-(4-fluorophenyl)piperazin-4-ium-1-carbothioamide Formula: C18H20ClFN3S+ MolecularWeight: 364.887903

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)C(=S)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)C(=S)NC3=CC=C(C=C3)F

InChI

InChI=1S/C18H19ClFN3S/c19-15-3-1-2-14(12-15)13-22-8-10-23(11-9-22)18(24)21-17-6-4-16(20)5-7-17/h1-7,12H,8-11,13H2,(H,21,24)/p+1