2-[4-[2-(4-chlorophenyl)ethylcarbamothioyl]piperazin-1-yl]-N-methyl-N-phenyl-ethanamide

Systemtic Name: 2-[4-[2-(4-chlorophenyl)ethylcarbamothioyl]piperazin-1-yl]-N-methyl-N-phenyl-ethanamide Openeye Name: 2-[4-[2-(4-chlorophenyl)ethylcarbamothioyl]piperazin-1-yl]-N-methyl-N-phenyl-acetamide CAS Name: 2-[4-[[2-(4-chlorophenyl)ethylamino]-sulfanylidenemethyl]-1-piperazinyl]-N-methyl-N-phenylacetamide IUPAC Name: 2-[4-[2-(4-chlorophenyl)ethylcarbamothioyl]piperazin-1-yl]-N-methyl-N-phenylacetamide Traditional Name: 2-[4-[2-(4-chlorophenyl)ethylthiocarbamoyl]piperazino]-N-methyl-N-phenyl-acetamide Formula: C22H27ClN4OS MolecularWeight: 430.99398

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CN2CCN(CC2)C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CN2CCN(CC2)C(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H27ClN4OS/c1-25(20-5-3-2-4-6-20)21(28)17-26-13-15-27(16-14-26)22(29)24-12-11-18-7-9-19(23)10-8-18/h2-10H,11-17H2,1H3,(H,24,29)