2-[4-[(3-bromophenyl)carbamothioyl]piperazin-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[(3-bromophenyl)carbamothioyl]piperazin-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[(3-bromophenyl)carbamothioyl]piperazin-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[(3-bromoanilino)-sulfanylidenemethyl]-1-piperazinyl]-N-propylacetamide IUPAC Name: 2-[4-[(3-bromophenyl)carbamothioyl]piperazin-1-yl]-N-propylacetamide Traditional Name: 2-[4-[(3-bromophenyl)thiocarbamoyl]piperazino]-N-propyl-acetamide Formula: C16H23BrN4OS MolecularWeight: 399.34902

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1CCN(CC1)C(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

CCCNC(=O)CN1CCN(CC1)C(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C16H23BrN4OS/c1-2-6-18-15(22)12-20-7-9-21(10-8-20)16(23)19-14-5-3-4-13(17)11-14/h3-5,11H,2,6-10,12H2,1H3,(H,18,22)(H,19,23)