2-(4-tert-butylphenyl)-N-[(Z)-1-(5-chloranylthiophen-2-yl)butylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(4-tert-butylphenyl)-N-[(Z)-1-(5-chloranylthiophen-2-yl)butylideneamino]quinoline-4-carboxamide Openeye Name: 2-(4-tert-butylphenyl)-N-[(Z)-1-(5-chloro-2-thienyl)butylideneamino]quinoline-4-carboxamide CAS Name: 2-(4-tert-butylphenyl)-N-[(Z)-1-(5-chloro-2-thiophenyl)butylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(4-tert-butylphenyl)-N-[(Z)-1-(5-chlorothiophen-2-yl)butylideneamino]quinoline-4-carboxamide Traditional Name: 2-(4-tert-butylphenyl)-N-[(Z)-1-(5-chloro-2-thienyl)butylideneamino]cinchoninamide Formula: C28H28ClN3OS MolecularWeight: 490.05942

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(S4)Cl

Isomeric SMILES

CCC/C(=N/NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)C(C)(C)C)/C4=CC=C(S4)Cl

InChI

InChI=1S/C28H28ClN3OS/c1-5-8-23(25-15-16-26(29)34-25)31-32-27(33)21-17-24(30-22-10-7-6-9-20(21)22)18-11-13-19(14-12-18)28(2,3)4/h6-7,9-17H,5,8H2,1-4H3,(H,32,33)/b31-23-