2-(4-butan-2-ylphenyl)-N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(4-butan-2-ylphenyl)-N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide Openeye Name: N-[(E)-(5-ethyl-2-thienyl)methyleneamino]-2-(4-sec-butylphenyl)quinoline-4-carboxamide CAS Name: 2-(4-butan-2-ylphenyl)-N-[(E)-(5-ethyl-2-thiophenyl)methylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(4-butan-2-ylphenyl)-N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide Traditional Name: N-[(E)-(5-ethyl-2-thienyl)methyleneamino]-2-(4-sec-butylphenyl)cinchoninamide Formula: C27H27N3OS MolecularWeight: 441.58778

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C=NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)CC

Isomeric SMILES

CCC1=CC=C(S1)/C=N/NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)CC

InChI

InChI=1S/C27H27N3OS/c1-4-18(3)19-10-12-20(13-11-19)26-16-24(23-8-6-7-9-25(23)29-26)27(31)30-28-17-22-15-14-21(5-2)32-22/h6-18H,4-5H2,1-3H3,(H,30,31)/b28-17+