2-(4-tert-butylphenyl)-N-[(E)-[1-(phenylmethyl)indol-3-yl]methylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(4-tert-butylphenyl)-N-[(E)-[1-(phenylmethyl)indol-3-yl]methylideneamino]quinoline-4-carboxamide Openeye Name: N-[(E)-(1-benzylindol-3-yl)methyleneamino]-2-(4-tert-butylphenyl)quinoline-4-carboxamide CAS Name: 2-(4-tert-butylphenyl)-N-[(E)-[1-(phenylmethyl)-3-indolyl]methylideneamino]-4-quinolinecarboxamide IUPAC Name: N-[(E)-(1-benzylindol-3-yl)methylideneamino]-2-(4-tert-butylphenyl)quinoline-4-carboxamide Traditional Name: N-[(E)-(1-benzylindol-3-yl)methyleneamino]-2-(4-tert-butylphenyl)cinchoninamide Formula: C36H32N4O MolecularWeight: 536.66548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=CC4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N/N=C/C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C36H32N4O/c1-36(2,3)28-19-17-26(18-20-28)33-21-31(30-14-7-9-15-32(30)38-33)35(41)39-37-22-27-24-40(23-25-11-5-4-6-12-25)34-16-10-8-13-29(27)34/h4-22,24H,23H2,1-3H3,(H,39,41)/b37-22+