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

Systemtic Name: N-(3-chlorophenyl)-4-ethanoyl-piperazine-1-carbothioamide Openeye Name: 4-acetyl-N-(3-chlorophenyl)piperazine-1-carbothioamide CAS Name: 4-acetyl-N-(3-chlorophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-acetyl-N-(3-chlorophenyl)piperazine-1-carbothioamide Traditional Name: 4-acetyl-N-(3-chlorophenyl)piperazine-1-carbothioamide Formula: C13H16ClN3OS MolecularWeight: 297.80364

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=S)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=S)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H16ClN3OS/c1-10(18)16-5-7-17(8-6-16)13(19)15-12-4-2-3-11(14)9-12/h2-4,9H,5-8H2,1H3,(H,15,19)