2-thiophen-2-yl-N-[3-[4-[3-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide

Systemtic Name: 2-thiophen-2-yl-N-[3-[4-[3-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide Openeye Name: 2-(2-thienyl)-N-[3-[4-[3-[[2-(2-thienyl)quinoline-4-carbonyl]amino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide CAS Name: N-[3-[4-[3-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]propyl]-1-piperazinyl]propyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: 2-thiophen-2-yl-N-[3-[4-[3-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide Traditional Name: 2-(2-thienyl)-N-[3-[4-[3-[[2-(2-thienyl)quinoline-4-carbonyl]amino]propyl]piperazino]propyl]cinchoninamide Formula: C38H38N6O2S2 MolecularWeight: 674.87732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)CCCNC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=CS7

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)CCCNC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=CS7

InChI

InChI=1S/C38H38N6O2S2/c45-37(29-25-33(35-13-5-23-47-35)41-31-11-3-1-9-27(29)31)39-15-7-17-43-19-21-44(22-20-43)18-8-16-40-38(46)30-26-34(36-14-6-24-48-36)42-32-12-4-2-10-28(30)32/h1-6,9-14,23-26H,7-8,15-22H2,(H,39,45)(H,40,46)