4-[(3-chlorophenyl)methyl]-N-(3-ethanoylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(3-chlorophenyl)methyl]-N-(3-ethanoylphenyl)piperazine-1-carbothioamide Openeye Name: N-(3-acetylphenyl)-4-[(3-chlorophenyl)methyl]piperazine-1-carbothioamide CAS Name: N-(3-acetylphenyl)-4-[(3-chlorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3-acetylphenyl)-4-[(3-chlorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(3-acetylphenyl)-4-(3-chlorobenzyl)piperazine-1-carbothioamide Formula: C20H22ClN3OS MolecularWeight: 387.92618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)N2CCN(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)N2CCN(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22ClN3OS/c1-15(25)17-5-3-7-19(13-17)22-20(26)24-10-8-23(9-11-24)14-16-4-2-6-18(21)12-16/h2-7,12-13H,8-11,14H2,1H3,(H,22,26)