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

Systemtic Name: 4-(phenylcarbonyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-benzoyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-benzoyl-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-benzoyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-benzoyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C19H18F3N3OS MolecularWeight: 393.42593

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18F3N3OS/c20-19(21,22)15-7-4-8-16(13-15)23-18(27)25-11-9-24(10-12-25)17(26)14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,23,27)