N-[(E)-(4-butoxyphenyl)methylideneamino]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[(E)-(4-butoxyphenyl)methyleneamino]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[(E)-(4-butoxybenzylidene)amino]-2-(2-thienyl)cinchoninamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

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