2-(4-tert-butylphenyl)-N-[(E)-1-(5-methylthiophen-2-yl)ethylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(4-tert-butylphenyl)-N-[(E)-1-(5-methylthiophen-2-yl)ethylideneamino]quinoline-4-carboxamide Openeye Name: 2-(4-tert-butylphenyl)-N-[(E)-1-(5-methyl-2-thienyl)ethylideneamino]quinoline-4-carboxamide CAS Name: 2-(4-tert-butylphenyl)-N-[(E)-1-(5-methyl-2-thiophenyl)ethylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(4-tert-butylphenyl)-N-[(E)-1-(5-methylthiophen-2-yl)ethylideneamino]quinoline-4-carboxamide Traditional Name: 2-(4-tert-butylphenyl)-N-[(E)-1-(5-methyl-2-thienyl)ethylideneamino]cinchoninamide Formula: C27H27N3OS MolecularWeight: 441.58778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)(C)C)C

Isomeric SMILES

CC1=CC=C(S1)/C(=N/NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)(C)C)/C

InChI

InChI=1S/C27H27N3OS/c1-17-10-15-25(32-17)18(2)29-30-26(31)22-16-24(28-23-9-7-6-8-21(22)23)19-11-13-20(14-12-19)27(3,4)5/h6-16H,1-5H3,(H,30,31)/b29-18+