N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(2,5-dimethoxyanilino)-sulfanylidenemethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[(2,5-dimethoxyphenyl)thiocarbamoyl]-2-phenyl-cinchoninamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O3S/c1-30-17-12-13-23(31-2)22(14-17)27-25(32)28-24(29)19-15-21(16-8-4-3-5-9-16)26-20-11-7-6-10-18(19)20/h3-15H,1-2H3,(H2,27,28,29,32)