4-[(4-fluorophenyl)carbonylcarbamothioylamino]-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 4-[(4-fluorophenyl)carbonylcarbamothioylamino]-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 4-[(4-fluorobenzoyl)carbamothioylamino]-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 4-[[[[(4-fluorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 4-[(4-fluorobenzoyl)carbamothioylamino]-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-[(4-fluorobenzoyl)thiocarbamoylamino]-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C22H15F4N3O2S MolecularWeight: 461.432013

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H15F4N3O2S/c23-16-8-4-13(5-9-16)20(31)29-21(32)28-17-10-6-14(7-11-17)19(30)27-18-3-1-2-15(12-18)22(24,25)26/h1-12H,(H,27,30)(H2,28,29,31,32)