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

Systemtic Name: 4-[(3-fluorophenyl)methyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-[(3-fluorophenyl)methyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-[(3-fluorophenyl)methyl]-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(3-fluorophenyl)methyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-(3-fluorobenzyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C19H19F4N3S MolecularWeight: 397.432873

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)F)C(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)F)C(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H19F4N3S/c20-16-5-1-3-14(11-16)13-25-7-9-26(10-8-25)18(27)24-17-6-2-4-15(12-17)19(21,22)23/h1-6,11-12H,7-10,13H2,(H,24,27)