2-[4-(2-phenylsulfanylethylcarbamothioyl)piperazin-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-(2-phenylsulfanylethylcarbamothioyl)piperazin-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-(2-phenylsulfanylethylcarbamothioyl)piperazin-1-yl]acetamide CAS Name: 2-[4-[[2-(phenylthio)ethylamino]-sulfanylidenemethyl]-1-piperazinyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-(2-phenylsulfanylethylcarbamothioyl)piperazin-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-[2-(phenylthio)ethylthiocarbamoyl]piperazino]acetamide Formula: C18H28N4OS2 MolecularWeight: 380.57112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CCN(CC1)C(=S)NCCSC2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)CN1CCN(CC1)C(=S)NCCSC2=CC=CC=C2

InChI

InChI=1S/C18H28N4OS2/c1-15(2)20-17(23)14-21-9-11-22(12-10-21)18(24)19-8-13-25-16-6-4-3-5-7-16/h3-7,15H,8-14H2,1-2H3,(H,19,24)(H,20,23)