4-[(2-fluorophenyl)methyl]-N-(phenylmethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-[(2-fluorophenyl)methyl]-N-(phenylmethyl)piperazin-4-ium-1-carbothioamide Openeye Name: N-benzyl-4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-carbothioamide CAS Name: 4-[(2-fluorophenyl)methyl]-N-(phenylmethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: N-benzyl-4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-carbothioamide Traditional Name: N-benzyl-4-(2-fluorobenzyl)piperazin-4-ium-1-carbothioamide Formula: C19H23FN3S+ MolecularWeight: 344.469423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=S)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C19H22FN3S/c20-18-9-5-4-8-17(18)15-22-10-12-23(13-11-22)19(24)21-14-16-6-2-1-3-7-16/h1-9H,10-15H2,(H,21,24)/p+1