2-(4-ethoxyphenyl)-N-[(E)-1-thiophen-2-ylpropylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(4-ethoxyphenyl)-N-[(E)-1-thiophen-2-ylpropylideneamino]quinoline-4-carboxamide Openeye Name: 2-(4-ethoxyphenyl)-N-[(E)-1-(2-thienyl)propylideneamino]quinoline-4-carboxamide CAS Name: 2-(4-ethoxyphenyl)-N-[(E)-1-thiophen-2-ylpropylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(4-ethoxyphenyl)-N-[(E)-1-thiophen-2-ylpropylideneamino]quinoline-4-carboxamide Traditional Name: 2-p-phenetyl-N-[(E)-1-(2-thienyl)propylideneamino]cinchoninamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)OCC)C4=CC=CS4

Isomeric SMILES

CC/C(=N\NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)OCC)/C4=CC=CS4

InChI

InChI=1S/C25H23N3O2S/c1-3-21(24-10-7-15-31-24)27-28-25(29)20-16-23(26-22-9-6-5-8-19(20)22)17-11-13-18(14-12-17)30-4-2/h5-16H,3-4H2,1-2H3,(H,28,29)/b27-21+