N-[4-[(3-chlorophenyl)methylcarbamothioylamino]phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[(3-chlorophenyl)methylcarbamothioylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[(3-chlorophenyl)methylcarbamothioylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[[[(3-chlorophenyl)methylamino]-sulfanylidenemethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[(3-chlorophenyl)methylcarbamothioylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[4-[(3-chlorobenzyl)thiocarbamoylamino]phenyl]-2-fluoro-benzamide Formula: C21H17ClFN3OS MolecularWeight: 413.895583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC(=CC=C3)Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC(=CC=C3)Cl)F

InChI

InChI=1S/C21H17ClFN3OS/c22-15-5-3-4-14(12-15)13-24-21(28)26-17-10-8-16(9-11-17)25-20(27)18-6-1-2-7-19(18)23/h1-12H,13H2,(H,25,27)(H2,24,26,28)