N-(3-ethanoylphenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-ethanoylphenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide Openeye Name: N-(3-acetylphenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide CAS Name: N-(3-acetylphenyl)-4-(4-fluorophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-acetylphenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide Traditional Name: N-(3-acetylphenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide Formula: C19H20FN3OS MolecularWeight: 357.445003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20FN3OS/c1-14(24)15-3-2-4-17(13-15)21-19(25)23-11-9-22(10-12-23)18-7-5-16(20)6-8-18/h2-8,13H,9-12H2,1H3,(H,21,25)