4-fluoranyl-N-[4-[(phenethylcarbamothioylamino)carbamoyl]phenyl]benzamide

Systemtic Name: 4-fluoranyl-N-[4-[(phenethylcarbamothioylamino)carbamoyl]phenyl]benzamide Openeye Name: 4-fluoro-N-[4-[(phenethylcarbamothioylamino)carbamoyl]phenyl]benzamide CAS Name: 4-fluoro-N-[4-[oxo-[[(phenethylamino)-sulfanylidenemethyl]hydrazo]methyl]phenyl]benzamide IUPAC Name: 4-fluoro-N-[4-[(phenethylcarbamothioylamino)carbamoyl]phenyl]benzamide Traditional Name: 4-fluoro-N-[4-[(phenethylthiocarbamoylamino)carbamoyl]phenyl]benzamide Formula: C23H21FN4O2S MolecularWeight: 436.501843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H21FN4O2S/c24-19-10-6-17(7-11-19)21(29)26-20-12-8-18(9-13-20)22(30)27-28-23(31)25-15-14-16-4-2-1-3-5-16/h1-13H,14-15H2,(H,26,29)(H,27,30)(H2,25,28,31)