N-(3-bromophenyl)-4-(phenylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-bromophenyl)-4-(phenylcarbonyl)piperazine-1-carbothioamide Openeye Name: 4-benzoyl-N-(3-bromophenyl)piperazine-1-carbothioamide CAS Name: 4-benzoyl-N-(3-bromophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-benzoyl-N-(3-bromophenyl)piperazine-1-carbothioamide Traditional Name: 4-benzoyl-N-(3-bromophenyl)piperazine-1-carbothioamide Formula: C18H18BrN3OS MolecularWeight: 404.32402

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=S)NC3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=S)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H18BrN3OS/c19-15-7-4-8-16(13-15)20-18(24)22-11-9-21(10-12-22)17(23)14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,20,24)