2-thiophen-2-yl-N-[8-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]octyl]quinoline-4-carboxamide

Systemtic Name: 2-thiophen-2-yl-N-[8-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]octyl]quinoline-4-carboxamide Openeye Name: 2-(2-thienyl)-N-[8-[[2-(2-thienyl)quinoline-4-carbonyl]amino]octyl]quinoline-4-carboxamide CAS Name: N-[8-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]octyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: 2-thiophen-2-yl-N-[8-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]octyl]quinoline-4-carboxamide Traditional Name: 2-(2-thienyl)-N-[8-[[2-(2-thienyl)quinoline-4-carbonyl]amino]octyl]cinchoninamide Formula: C36H34N4O2S2 MolecularWeight: 618.81076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NCCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CS6

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NCCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CS6

InChI

InChI=1S/C36H34N4O2S2/c41-35(27-23-31(33-17-11-21-43-33)39-29-15-7-5-13-25(27)29)37-19-9-3-1-2-4-10-20-38-36(42)28-24-32(34-18-12-22-44-34)40-30-16-8-6-14-26(28)30/h5-8,11-18,21-24H,1-4,9-10,19-20H2,(H,37,41)(H,38,42)