4-(2-fluorophenyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2-fluorophenyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide Openeye Name: 4-(2-fluorophenyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide CAS Name: 4-(2-fluorophenyl)-N-[3-(methylthio)propyl]-1-piperazinecarbothioamide IUPAC Name: 4-(2-fluorophenyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide Traditional Name: 4-(2-fluorophenyl)-N-[3-(methylthio)propyl]piperazine-1-carbothioamide Formula: C15H22FN3S2 MolecularWeight: 327.483683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)N1CCN(CC1)C2=CC=CC=C2F

Isomeric SMILES

CSCCCNC(=S)N1CCN(CC1)C2=CC=CC=C2F

InChI

InChI=1S/C15H22FN3S2/c1-21-12-4-7-17-15(20)19-10-8-18(9-11-19)14-6-3-2-5-13(14)16/h2-3,5-6H,4,7-12H2,1H3,(H,17,20)