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

Systemtic Name: N-[ethyl(phenyl)carbamothioyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[ethyl(phenyl)carbamothioyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(N-ethylanilino)-sulfanylidenemethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[ethyl(phenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[ethyl(phenyl)thiocarbamoyl]-2-phenyl-cinchoninamide Formula: C25H21N3OS MolecularWeight: 411.51874

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3OS/c1-2-28(19-13-7-4-8-14-19)25(30)27-24(29)21-17-23(18-11-5-3-6-12-18)26-22-16-10-9-15-20(21)22/h3-17H,2H2,1H3,(H,27,29,30)