4-phenyl-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-phenyl-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-phenyl-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-phenyl-N-[2-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-phenyl-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-phenyl-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C18H18F3N3S MolecularWeight: 365.41583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=S)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=S)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H18F3N3S/c19-18(20,21)15-8-4-5-9-16(15)22-17(25)24-12-10-23(11-13-24)14-6-2-1-3-7-14/h1-9H,10-13H2,(H,22,25)