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

Systemtic Name: 4-(4-ethanoyl-2-fluoranyl-phenyl)-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-acetyl-2-fluoro-phenyl)-N-(4-isopropylphenyl)piperazine-1-carbothioamide CAS Name: 4-(4-acetyl-2-fluorophenyl)-N-(4-propan-2-ylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetyl-2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-acetyl-2-fluoro-phenyl)-N-p-cumenyl-piperazine-1-carbothioamide Formula: C22H26FN3OS MolecularWeight: 399.524743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26FN3OS/c1-15(2)17-4-7-19(8-5-17)24-22(28)26-12-10-25(11-13-26)21-9-6-18(16(3)27)14-20(21)23/h4-9,14-15H,10-13H2,1-3H3,(H,24,28)