N-[(E)-[3,4-bis(phenylmethoxy)phenyl]methylideneamino]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[(E)-[3,4-bis(phenylmethoxy)phenyl]methylideneamino]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[(E)-(3,4-dibenzyloxyphenyl)methyleneamino]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[(E)-[3,4-bis(phenylmethoxy)phenyl]methylideneamino]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[(E)-[3,4-bis(phenylmethoxy)phenyl]methylideneamino]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[(E)-(3,4-dibenzoxybenzylidene)amino]-2-(2-thienyl)cinchoninamide Formula: C35H27N3O3S MolecularWeight: 569.67218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=NNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)OCC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)/C=N/NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)OCC6=CC=CC=C6

InChI

InChI=1S/C35H27N3O3S/c39-35(29-21-31(34-16-9-19-42-34)37-30-15-8-7-14-28(29)30)38-36-22-27-17-18-32(40-23-25-10-3-1-4-11-25)33(20-27)41-24-26-12-5-2-6-13-26/h1-22H,23-24H2,(H,38,39)/b36-22+