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

Systemtic Name: 4-ethyl-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-ethyl-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-ethyl-N-[2-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-ethyl-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-ethyl-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C14H18F3N3S MolecularWeight: 317.37303

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=S)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCN1CCN(CC1)C(=S)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C14H18F3N3S/c1-2-19-7-9-20(10-8-19)13(21)18-12-6-4-3-5-11(12)14(15,16)17/h3-6H,2,7-10H2,1H3,(H,18,21)