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

Systemtic Name: N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide Openeye Name: N-butyl-4-[(E)-cinnamyl]piperazine-1-carbothioamide CAS Name: N-butyl-4-[(E)-3-phenylprop-2-enyl]-1-piperazinecarbothioamide IUPAC Name: N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide Traditional Name: N-butyl-4-[(E)-cinnamyl]piperazine-1-carbothioamide Formula: C18H27N3S MolecularWeight: 317.49208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCN(CC1)CC=CC2=CC=CC=C2

Isomeric SMILES

CCCCNC(=S)N1CCN(CC1)C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H27N3S/c1-2-3-11-19-18(22)21-15-13-20(14-16-21)12-7-10-17-8-5-4-6-9-17/h4-10H,2-3,11-16H2,1H3,(H,19,22)/b10-7+