2-[(4-fluorophenyl)methylcarbamothioyl-methyl-amino]-N-methyl-ethanamide

Systemtic Name: 2-[(4-fluorophenyl)methylcarbamothioyl-methyl-amino]-N-methyl-ethanamide Openeye Name: 2-[(4-fluorophenyl)methylcarbamothioyl-methyl-amino]-N-methyl-acetamide CAS Name: 2-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]-methylamino]-N-methylacetamide IUPAC Name: 2-[(4-fluorophenyl)methylcarbamothioyl-methylamino]-N-methylacetamide Traditional Name: 2-[(4-fluorobenzyl)thiocarbamoyl-methyl-amino]-N-methyl-acetamide Formula: C12H16FN3OS MolecularWeight: 269.338343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN(C)C(=S)NCC1=CC=C(C=C1)F

Isomeric SMILES

CNC(=O)CN(C)C(=S)NCC1=CC=C(C=C1)F

InChI

InChI=1S/C12H16FN3OS/c1-14-11(17)8-16(2)12(18)15-7-9-3-5-10(13)6-4-9/h3-6H,7-8H2,1-2H3,(H,14,17)(H,15,18)