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

Systemtic Name: N-(3-chlorophenyl)-4-(4-ethanoylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-acetylphenyl)-N-(3-chlorophenyl)piperazine-1-carbothioamide CAS Name: 4-(4-acetylphenyl)-N-(3-chlorophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetylphenyl)-N-(3-chlorophenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-acetylphenyl)-N-(3-chlorophenyl)piperazine-1-carbothioamide Formula: C19H20ClN3OS MolecularWeight: 373.8996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN3OS/c1-14(24)15-5-7-18(8-6-15)22-9-11-23(12-10-22)19(25)21-17-4-2-3-16(20)13-17/h2-8,13H,9-12H2,1H3,(H,21,25)