N-[2-(4-propan-2-ylphenyl)-3H-isoindol-1-ylidene]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(4-propan-2-ylphenyl)-3H-isoindol-1-ylidene]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-(4-isopropylphenyl)isoindolin-1-ylidene]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[2-(4-propan-2-ylphenyl)-3H-isoindol-1-ylidene]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(4-propan-2-ylphenyl)-3H-isoindol-1-ylidene]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(2-p-cumenylisoindolin-1-ylidene)-2-(2-thienyl)cinchoninamide Formula: C31H25N3OS MolecularWeight: 487.6147

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CS6

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CS6

InChI

InChI=1S/C31H25N3OS/c1-20(2)21-13-15-23(16-14-21)34-19-22-8-3-4-9-24(22)30(34)33-31(35)26-18-28(29-12-7-17-36-29)32-27-11-6-5-10-25(26)27/h3-18,20H,19H2,1-2H3