N-[(4-methylphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide

Systemtic Name: N-[(4-methylphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide Openeye Name: 4-[(E)-cinnamyl]-N-(p-tolylmethyl)piperazine-1-carbothioamide CAS Name: N-[(4-methylphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]-1-piperazinecarbothioamide IUPAC Name: N-[(4-methylphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide Traditional Name: 4-[(E)-cinnamyl]-N-(4-methylbenzyl)piperazine-1-carbothioamide Formula: C22H27N3S MolecularWeight: 365.53488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)N2CCN(CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)N2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H27N3S/c1-19-9-11-21(12-10-19)18-23-22(26)25-16-14-24(15-17-25)13-5-8-20-6-3-2-4-7-20/h2-12H,13-18H2,1H3,(H,23,26)/b8-5+