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

Systemtic Name: 2-thiophen-2-yl-N-[4-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]butyl]quinoline-4-carboxamide Openeye Name: 2-(2-thienyl)-N-[4-[[2-(2-thienyl)quinoline-4-carbonyl]amino]butyl]quinoline-4-carboxamide CAS Name: N-[4-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]butyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: 2-thiophen-2-yl-N-[4-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]butyl]quinoline-4-carboxamide Traditional Name: 2-(2-thienyl)-N-[4-[[2-(2-thienyl)quinoline-4-carbonyl]amino]butyl]cinchoninamide Formula: C32H26N4O2S2 MolecularWeight: 562.70444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H26N4O2S2/c37-31(23-19-27(29-13-7-17-39-29)35-25-11-3-1-9-21(23)25)33-15-5-6-16-34-32(38)24-20-28(30-14-8-18-40-30)36-26-12-4-2-10-22(24)26/h1-4,7-14,17-20H,5-6,15-16H2,(H,33,37)(H,34,38)