N-phenethyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide

Systemtic Name: N-phenethyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: N-phenethyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: N-phenethyl-4-[3-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: N-phenethyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: N-phenethyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C20H22F3N3S MolecularWeight: 393.46899

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H22F3N3S/c21-20(22,23)17-7-4-8-18(15-17)25-11-13-26(14-12-25)19(27)24-10-9-16-5-2-1-3-6-16/h1-8,15H,9-14H2,(H,24,27)