N-[(2-cyanophenyl)carbamothioyl]-2-(furan-2-yl)quinoline-4-carboxamide

Systemtic Name: N-[(2-cyanophenyl)carbamothioyl]-2-(furan-2-yl)quinoline-4-carboxamide Openeye Name: N-[(2-cyanophenyl)carbamothioyl]-2-(2-furyl)quinoline-4-carboxamide CAS Name: N-[(2-cyanoanilino)-sulfanylidenemethyl]-2-(2-furanyl)-4-quinolinecarboxamide IUPAC Name: N-[(2-cyanophenyl)carbamothioyl]-2-(furan-2-yl)quinoline-4-carboxamide Traditional Name: N-[(2-cyanophenyl)thiocarbamoyl]-2-(2-furyl)cinchoninamide Formula: C22H14N4O2S MolecularWeight: 398.43716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C22H14N4O2S/c23-13-14-6-1-3-8-17(14)25-22(29)26-21(27)16-12-19(20-10-5-11-28-20)24-18-9-4-2-7-15(16)18/h1-12H,(H2,25,26,27,29)