4-[[fluoranyl-[3-(trifluoromethyl)phenyl]methyl]carbamothioylamino]benzamide

Systemtic Name: 4-[[fluoranyl-[3-(trifluoromethyl)phenyl]methyl]carbamothioylamino]benzamide Openeye Name: 4-[[fluoro-[3-(trifluoromethyl)phenyl]methyl]carbamothioylamino]benzamide CAS Name: 4-[[[[fluoro-[3-(trifluoromethyl)phenyl]methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 4-[[fluoro-[3-(trifluoromethyl)phenyl]methyl]carbamothioylamino]benzamide Traditional Name: 4-[[fluoro-[3-(trifluoromethyl)phenyl]methyl]thiocarbamoylamino]benzamide Formula: C16H13F4N3OS MolecularWeight: 371.352533

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13F4N3OS/c17-13(10-2-1-3-11(8-10)16(18,19)20)23-15(25)22-12-6-4-9(5-7-12)14(21)24/h1-8,13H,(H2,21,24)(H2,22,23,25)