N-[(4-ethoxy-2-nitro-phenyl)carbamothioyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[(4-ethoxy-2-nitro-phenyl)carbamothioyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[(4-ethoxy-2-nitro-phenyl)carbamothioyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(4-ethoxy-2-nitroanilino)-sulfanylidenemethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[(4-ethoxy-2-nitro-phenyl)thiocarbamoyl]-2-phenyl-cinchoninamide Formula: C25H20N4O4S MolecularWeight: 472.5157

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H20N4O4S/c1-2-33-17-12-13-21(23(14-17)29(31)32)27-25(34)28-24(30)19-15-22(16-8-4-3-5-9-16)26-20-11-7-6-10-18(19)20/h3-15H,2H2,1H3,(H2,27,28,30,34)