2-fluoranyl-N-[2,2,2-tris(chloranyl)-1-[(4-fluorophenyl)carbamothioylamino]ethyl]benzamide

Systemtic Name: 2-fluoranyl-N-[2,2,2-tris(chloranyl)-1-[(4-fluorophenyl)carbamothioylamino]ethyl]benzamide Openeye Name: 2-fluoro-N-[2,2,2-trichloro-1-[(4-fluorophenyl)carbamothioylamino]ethyl]benzamide CAS Name: 2-fluoro-N-[2,2,2-trichloro-1-[[(4-fluoroanilino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 2-fluoro-N-[2,2,2-trichloro-1-[(4-fluorophenyl)carbamothioylamino]ethyl]benzamide Traditional Name: 2-fluoro-N-[2,2,2-trichloro-1-[(4-fluorophenyl)thiocarbamoylamino]ethyl]benzamide Formula: C16H12Cl3F2N3OS MolecularWeight: 438.706786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12Cl3F2N3OS/c17-16(18,19)14(23-13(25)11-3-1-2-4-12(11)21)24-15(26)22-10-7-5-9(20)6-8-10/h1-8,14H,(H,23,25)(H2,22,24,26)