N-(2-chlorophenyl)-2-[4-[(4-fluorophenyl)methylcarbamothioyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2-chlorophenyl)-2-[4-[(4-fluorophenyl)methylcarbamothioyl]piperazin-1-yl]ethanamide Openeye Name: N-(2-chlorophenyl)-2-[4-[(4-fluorophenyl)methylcarbamothioyl]piperazin-1-yl]acetamide CAS Name: N-(2-chlorophenyl)-2-[4-[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-chlorophenyl)-2-[4-[(4-fluorophenyl)methylcarbamothioyl]piperazin-1-yl]acetamide Traditional Name: N-(2-chlorophenyl)-2-[4-[(4-fluorobenzyl)thiocarbamoyl]piperazino]acetamide Formula: C20H22ClFN4OS MolecularWeight: 420.931283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC=C2Cl)C(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC=C2Cl)C(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H22ClFN4OS/c21-17-3-1-2-4-18(17)24-19(27)14-25-9-11-26(12-10-25)20(28)23-13-15-5-7-16(22)8-6-15/h1-8H,9-14H2,(H,23,28)(H,24,27)