2-[2,2,2-tris(fluoranyl)-1-isocyanato-1-phenyl-ethyl]sulfanylquinoline

Systemtic Name: 2-[2,2,2-tris(fluoranyl)-1-isocyanato-1-phenyl-ethyl]sulfanylquinoline Openeye Name: 2-(2,2,2-trifluoro-1-isocyanato-1-phenyl-ethyl)sulfanylquinoline CAS Name: 2-[(2,2,2-trifluoro-1-isocyanato-1-phenylethyl)thio]quinoline IUPAC Name: 2-(2,2,2-trifluoro-1-isocyanato-1-phenylethyl)sulfanylquinoline Traditional Name: 2-[(2,2,2-trifluoro-1-isocyanato-1-phenyl-ethyl)thio]quinoline Formula: C18H11F3N2OS MolecularWeight: 360.35295

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(F)(F)F)(N=C=O)SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

C1=CC=C(C=C1)C(C(F)(F)F)(N=C=O)SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H11F3N2OS/c19-18(20,21)17(22-12-24,14-7-2-1-3-8-14)25-16-11-10-13-6-4-5-9-15(13)23-16/h1-11H