2-(4-tert-butylphenyl)-N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(4-tert-butylphenyl)-N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide Openeye Name: 2-(4-tert-butylphenyl)-N-[(E)-(5-ethyl-2-thienyl)methyleneamino]quinoline-4-carboxamide CAS Name: 2-(4-tert-butylphenyl)-N-[(E)-(5-ethyl-2-thiophenyl)methylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(4-tert-butylphenyl)-N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide Traditional Name: 2-(4-tert-butylphenyl)-N-[(E)-(5-ethyl-2-thienyl)methyleneamino]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)(C)C

Isomeric SMILES

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

InChI

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