2-(3-butoxyphenyl)-N-[(E)-thiophen-3-ylmethylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(3-butoxyphenyl)-N-[(E)-thiophen-3-ylmethylideneamino]quinoline-4-carboxamide Openeye Name: 2-(3-butoxyphenyl)-N-[(E)-3-thienylmethyleneamino]quinoline-4-carboxamide CAS Name: 2-(3-butoxyphenyl)-N-[(E)-3-thiophenylmethylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(3-butoxyphenyl)-N-[(E)-thiophen-3-ylmethylideneamino]quinoline-4-carboxamide Traditional Name: 2-(3-butoxyphenyl)-N-[(E)-3-thenylideneamino]cinchoninamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=CC4=CSC=C4

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N/N=C/C4=CSC=C4

InChI

InChI=1S/C25H23N3O2S/c1-2-3-12-30-20-8-6-7-19(14-20)24-15-22(21-9-4-5-10-23(21)27-24)25(29)28-26-16-18-11-13-31-17-18/h4-11,13-17H,2-3,12H2,1H3,(H,28,29)/b26-16+