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

Systemtic Name: 4-fluoranyl-N-[2,2,2-tris(chloranyl)-1-[(2,4-dimethylphenyl)carbamothioylamino]ethyl]benzamide Openeye Name: 4-fluoro-N-[2,2,2-trichloro-1-[(2,4-dimethylphenyl)carbamothioylamino]ethyl]benzamide CAS Name: 4-fluoro-N-[2,2,2-trichloro-1-[[(2,4-dimethylanilino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 4-fluoro-N-[2,2,2-trichloro-1-[(2,4-dimethylphenyl)carbamothioylamino]ethyl]benzamide Traditional Name: 4-fluoro-N-[2,2,2-trichloro-1-[(2,4-dimethylphenyl)thiocarbamoylamino]ethyl]benzamide Formula: C18H17Cl3FN3OS MolecularWeight: 448.769483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C18H17Cl3FN3OS/c1-10-3-8-14(11(2)9-10)23-17(27)25-16(18(19,20)21)24-15(26)12-4-6-13(22)7-5-12/h3-9,16H,1-2H3,(H,24,26)(H2,23,25,27)