4-(4-ethanoylphenyl)-N-(2-methylpropyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-ethanoylphenyl)-N-(2-methylpropyl)piperazine-1-carbothioamide Openeye Name: 4-(4-acetylphenyl)-N-isobutyl-piperazine-1-carbothioamide CAS Name: 4-(4-acetylphenyl)-N-(2-methylpropyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetylphenyl)-N-(2-methylpropyl)piperazine-1-carbothioamide Traditional Name: 4-(4-acetylphenyl)-N-isobutyl-piperazine-1-carbothioamide Formula: C17H25N3OS MolecularWeight: 319.4649

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=S)N1CCN(CC1)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC(C)CNC(=S)N1CCN(CC1)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C17H25N3OS/c1-13(2)12-18-17(22)20-10-8-19(9-11-20)16-6-4-15(5-7-16)14(3)21/h4-7,13H,8-12H2,1-3H3,(H,18,22)