N-ethyl-2-(4-fluorophenyl)-N-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]quinoline-4-carboxamide

Systemtic Name: N-ethyl-2-(4-fluorophenyl)-N-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]quinoline-4-carboxamide Openeye Name: N-ethyl-2-(4-fluorophenyl)-N-[2-oxo-2-(2-thienylmethylamino)ethyl]quinoline-4-carboxamide CAS Name: N-ethyl-2-(4-fluorophenyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-4-quinolinecarboxamide IUPAC Name: N-ethyl-2-(4-fluorophenyl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]quinoline-4-carboxamide Traditional Name: N-ethyl-2-(4-fluorophenyl)-N-[2-keto-2-(2-thenylamino)ethyl]cinchoninamide Formula: C25H22FN3O2S MolecularWeight: 447.524483

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=CS1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

CCN(CC(=O)NCC1=CC=CS1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN3O2S/c1-2-29(16-24(30)27-15-19-6-5-13-32-19)25(31)21-14-23(17-9-11-18(26)12-10-17)28-22-8-4-3-7-20(21)22/h3-14H,2,15-16H2,1H3,(H,27,30)