6-ethanoyl-2-(4-nitrophenyl)-N-(phenylcarbamothioyl)quinoline-4-carboxamide

Systemtic Name: 6-ethanoyl-2-(4-nitrophenyl)-N-(phenylcarbamothioyl)quinoline-4-carboxamide Openeye Name: 6-acetyl-2-(4-nitrophenyl)-N-(phenylcarbamothioyl)quinoline-4-carboxamide CAS Name: 6-acetyl-N-[anilino(sulfanylidene)methyl]-2-(4-nitrophenyl)-4-quinolinecarboxamide IUPAC Name: 6-acetyl-2-(4-nitrophenyl)-N-(phenylcarbamothioyl)quinoline-4-carboxamide Traditional Name: 6-acetyl-2-(4-nitrophenyl)-N-(phenylthiocarbamoyl)cinchoninamide Formula: C25H18N4O4S MolecularWeight: 470.49982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)NC(=S)NC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)NC(=S)NC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H18N4O4S/c1-15(30)17-9-12-22-20(13-17)21(24(31)28-25(34)26-18-5-3-2-4-6-18)14-23(27-22)16-7-10-19(11-8-16)29(32)33/h2-14H,1H3,(H2,26,28,31,34)