4-(4-ethanoyl-2-fluoranyl-phenyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-ethanoyl-2-fluoranyl-phenyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide Openeye Name: 4-(4-acetyl-2-fluoro-phenyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide CAS Name: 4-(4-acetyl-2-fluorophenyl)-N-[3-(methylthio)propyl]-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetyl-2-fluorophenyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide Traditional Name: 4-(4-acetyl-2-fluoro-phenyl)-N-[3-(methylthio)propyl]piperazine-1-carbothioamide Formula: C17H24FN3OS2 MolecularWeight: 369.520363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=S)NCCCSC)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=S)NCCCSC)F

InChI

InChI=1S/C17H24FN3OS2/c1-13(22)14-4-5-16(15(18)12-14)20-7-9-21(10-8-20)17(23)19-6-3-11-24-2/h4-5,12H,3,6-11H2,1-2H3,(H,19,23)