2-(4-ethylphenoxy)-N-[2,2,2-tris(chloranyl)-1-[(4-fluorophenyl)carbamothioylamino]ethyl]ethanamide

Systemtic Name: 2-(4-ethylphenoxy)-N-[2,2,2-tris(chloranyl)-1-[(4-fluorophenyl)carbamothioylamino]ethyl]ethanamide Openeye Name: 2-(4-ethylphenoxy)-N-[2,2,2-trichloro-1-[(4-fluorophenyl)carbamothioylamino]ethyl]acetamide CAS Name: 2-(4-ethylphenoxy)-N-[2,2,2-trichloro-1-[[(4-fluoroanilino)-sulfanylidenemethyl]amino]ethyl]acetamide IUPAC Name: 2-(4-ethylphenoxy)-N-[2,2,2-trichloro-1-[(4-fluorophenyl)carbamothioylamino]ethyl]acetamide Traditional Name: 2-(4-ethylphenoxy)-N-[2,2,2-trichloro-1-[(4-fluorophenyl)thiocarbamoylamino]ethyl]acetamide Formula: C19H19Cl3FN3O2S MolecularWeight: 478.795463

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C19H19Cl3FN3O2S/c1-2-12-3-9-15(10-4-12)28-11-16(27)25-17(19(20,21)22)26-18(29)24-14-7-5-13(23)6-8-14/h3-10,17H,2,11H2,1H3,(H,25,27)(H2,24,26,29)