2-pyridin-3-yl-N-[3-(thiophen-2-ylcarbonylamino)phenyl]quinoline-4-carboxamide

Systemtic Name: 2-pyridin-3-yl-N-[3-(thiophen-2-ylcarbonylamino)phenyl]quinoline-4-carboxamide Openeye Name: 2-(3-pyridyl)-N-[3-(thiophene-2-carbonylamino)phenyl]quinoline-4-carboxamide CAS Name: N-[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 2-pyridin-3-yl-N-[3-(thiophene-2-carbonylamino)phenyl]quinoline-4-carboxamide Traditional Name: 2-(3-pyridyl)-N-[3-(2-thenoylamino)phenyl]cinchoninamide Formula: C26H18N4O2S MolecularWeight: 450.51172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)NC4=CC(=CC=C4)NC(=O)C5=CC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)NC4=CC(=CC=C4)NC(=O)C5=CC=CS5

InChI

InChI=1S/C26H18N4O2S/c31-25(28-18-7-3-8-19(14-18)29-26(32)24-11-5-13-33-24)21-15-23(17-6-4-12-27-16-17)30-22-10-2-1-9-20(21)22/h1-16H,(H,28,31)(H,29,32)