N-(2-bromophenyl)-4-ethanoyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-bromophenyl)-4-ethanoyl-piperazine-1-carbothioamide Openeye Name: 4-acetyl-N-(2-bromophenyl)piperazine-1-carbothioamide CAS Name: 4-acetyl-N-(2-bromophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-acetyl-N-(2-bromophenyl)piperazine-1-carbothioamide Traditional Name: 4-acetyl-N-(2-bromophenyl)piperazine-1-carbothioamide Formula: C13H16BrN3OS MolecularWeight: 342.25464

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=S)NC2=CC=CC=C2Br

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=S)NC2=CC=CC=C2Br

InChI

InChI=1S/C13H16BrN3OS/c1-10(18)16-6-8-17(9-7-16)13(19)15-12-5-3-2-4-11(12)14/h2-5H,6-9H2,1H3,(H,15,19)