2,2,2-tris(fluoranyl)-N-[4-(pyridin-4-ylmethylcarbamothioylamino)phenyl]ethanamide

Systemtic Name: 2,2,2-tris(fluoranyl)-N-[4-(pyridin-4-ylmethylcarbamothioylamino)phenyl]ethanamide Openeye Name: 2,2,2-trifluoro-N-[4-(4-pyridylmethylcarbamothioylamino)phenyl]acetamide CAS Name: 2,2,2-trifluoro-N-[4-[[(pyridin-4-ylmethylamino)-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: 2,2,2-trifluoro-N-[4-(pyridin-4-ylmethylcarbamothioylamino)phenyl]acetamide Traditional Name: 2,2,2-trifluoro-N-[4-(4-pyridylmethylthiocarbamoylamino)phenyl]acetamide Formula: C15H13F3N4OS MolecularWeight: 354.35013

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C(F)(F)F)NC(=S)NCC2=CC=NC=C2

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C(F)(F)F)NC(=S)NCC2=CC=NC=C2

InChI

InChI=1S/C15H13F3N4OS/c16-15(17,18)13(23)21-11-1-3-12(4-2-11)22-14(24)20-9-10-5-7-19-8-6-10/h1-8H,9H2,(H,21,23)(H2,20,22,24)