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

Systemtic Name: 4-[(E)-3-phenylprop-2-enyl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-[(E)-cinnamyl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-[(E)-3-phenylprop-2-enyl]-N-[4-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(E)-3-phenylprop-2-enyl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-[(E)-cinnamyl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C21H22F3N3S MolecularWeight: 405.47969

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H22F3N3S/c22-21(23,24)18-8-10-19(11-9-18)25-20(28)27-15-13-26(14-16-27)12-4-7-17-5-2-1-3-6-17/h1-11H,12-16H2,(H,25,28)/b7-4+