2-(4-tert-butylphenyl)-N-[(E)-1-[4-(furan-2-ylcarbonylamino)phenyl]ethylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(4-tert-butylphenyl)-N-[(E)-1-[4-(furan-2-ylcarbonylamino)phenyl]ethylideneamino]quinoline-4-carboxamide Openeye Name: 2-(4-tert-butylphenyl)-N-[(E)-1-[4-(furan-2-carbonylamino)phenyl]ethylideneamino]quinoline-4-carboxamide CAS Name: 2-(4-tert-butylphenyl)-N-[(E)-1-[4-[[2-furanyl(oxo)methyl]amino]phenyl]ethylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(4-tert-butylphenyl)-N-[(E)-1-[4-(furan-2-carbonylamino)phenyl]ethylideneamino]quinoline-4-carboxamide Traditional Name: 2-(4-tert-butylphenyl)-N-[(E)-1-[4-(2-furoylamino)phenyl]ethylideneamino]cinchoninamide Formula: C33H30N4O3 MolecularWeight: 530.6163

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(C=C4)NC(=O)C5=CC=CO5

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)C(C)(C)C)/C4=CC=C(C=C4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C33H30N4O3/c1-21(22-13-17-25(18-14-22)34-32(39)30-10-7-19-40-30)36-37-31(38)27-20-29(35-28-9-6-5-8-26(27)28)23-11-15-24(16-12-23)33(2,3)4/h5-20H,1-4H3,(H,34,39)(H,37,38)/b36-21+