2-cyano-N-[4-[1-(2-fluorophenyl)ethylcarbamothioylamino]phenyl]benzamide

Systemtic Name: 2-cyano-N-[4-[1-(2-fluorophenyl)ethylcarbamothioylamino]phenyl]benzamide Openeye Name: 2-cyano-N-[4-[1-(2-fluorophenyl)ethylcarbamothioylamino]phenyl]benzamide CAS Name: 2-cyano-N-[4-[[[1-(2-fluorophenyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 2-cyano-N-[4-[1-(2-fluorophenyl)ethylcarbamothioylamino]phenyl]benzamide Traditional Name: 2-cyano-N-[4-[1-(2-fluorophenyl)ethylthiocarbamoylamino]phenyl]benzamide Formula: C23H19FN4OS MolecularWeight: 418.486563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1F)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CC(C1=CC=CC=C1F)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C23H19FN4OS/c1-15(19-7-4-5-9-21(19)24)26-23(30)28-18-12-10-17(11-13-18)27-22(29)20-8-3-2-6-16(20)14-25/h2-13,15H,1H3,(H,27,29)(H2,26,28,30)