N-naphthalen-1-yl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbothioamide

Systemtic Name: N-naphthalen-1-yl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbothioamide Openeye Name: 4-[(E)-cinnamyl]-N-(1-naphthyl)piperazin-4-ium-1-carbothioamide CAS Name: N-(1-naphthalenyl)-4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumcarbothioamide IUPAC Name: N-naphthalen-1-yl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbothioamide Traditional Name: 4-[(E)-cinnamyl]-N-(1-naphthyl)piperazin-4-ium-1-carbothioamide Formula: C24H26N3S+ MolecularWeight: 388.54834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)C(=S)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)C(=S)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H25N3S/c28-24(25-23-14-6-12-21-11-4-5-13-22(21)23)27-18-16-26(17-19-27)15-7-10-20-8-2-1-3-9-20/h1-14H,15-19H2,(H,25,28)/p+1/b10-7+