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

Systemtic Name: 4-(4-ethanoyl-2-fluoranyl-phenyl)-N-(4-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-acetyl-2-fluoro-phenyl)-N-(4-methoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(4-acetyl-2-fluorophenyl)-N-(4-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetyl-2-fluorophenyl)-N-(4-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-acetyl-2-fluoro-phenyl)-N-(4-methoxyphenyl)piperazine-1-carbothioamide Formula: C20H22FN3O2S MolecularWeight: 387.470983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)OC)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)OC)F

InChI

InChI=1S/C20H22FN3O2S/c1-14(25)15-3-8-19(18(21)13-15)23-9-11-24(12-10-23)20(27)22-16-4-6-17(26-2)7-5-16/h3-8,13H,9-12H2,1-2H3,(H,22,27)