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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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