N-(3,4-dihydro-2H-thiochromen-4-yl)-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 2-(4-pyridyl)-N-thiochroman-4-yl-quinoline-4-carboxamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: 2-(4-pyridyl)-N-thiochroman-4-yl-cinchoninamide Formula: C24H19N3OS MolecularWeight: 397.49216

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5

InChI

InChI=1S/C24H19N3OS/c28-24(27-21-11-14-29-23-8-4-2-6-18(21)23)19-15-22(16-9-12-25-13-10-16)26-20-7-3-1-5-17(19)20/h1-10,12-13,15,21H,11,14H2,(H,27,28)