2-(3-butoxyphenyl)-N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(3-butoxyphenyl)-N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide Openeye Name: 2-(3-butoxyphenyl)-N-[(E)-(5-ethyl-2-thienyl)methyleneamino]quinoline-4-carboxamide CAS Name: 2-(3-butoxyphenyl)-N-[(E)-(5-ethyl-2-thiophenyl)methylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(3-butoxyphenyl)-N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide Traditional Name: 2-(3-butoxyphenyl)-N-[(E)-(5-ethyl-2-thienyl)methyleneamino]cinchoninamide Formula: C27H27N3O2S MolecularWeight: 457.58718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=CC4=CC=C(S4)CC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N/N=C/C4=CC=C(S4)CC

InChI

InChI=1S/C27H27N3O2S/c1-3-5-15-32-20-10-8-9-19(16-20)26-17-24(23-11-6-7-12-25(23)29-26)27(31)30-28-18-22-14-13-21(4-2)33-22/h6-14,16-18H,3-5,15H2,1-2H3,(H,30,31)/b28-18+