N-[(E)-1-(5-chloranylthiophen-2-yl)propylideneamino]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(E)-1-(5-chloranylthiophen-2-yl)propylideneamino]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Openeye Name: N-[(E)-1-(5-chloro-2-thienyl)propylideneamino]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide CAS Name: N-[(E)-1-(5-chloro-2-thiophenyl)propylideneamino]-2-(3,4-dimethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(E)-1-(5-chlorothiophen-2-yl)propylideneamino]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Traditional Name: N-[(E)-1-(5-chloro-2-thienyl)propylideneamino]-2-(3,4-dimethylphenyl)cinchoninamide Formula: C25H22ClN3OS MolecularWeight: 447.97968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22ClN3OS/c1-4-20(23-11-12-24(26)31-23)28-29-25(30)19-14-22(17-10-9-15(2)16(3)13-17)27-21-8-6-5-7-18(19)21/h5-14H,4H2,1-3H3,(H,29,30)/b28-20+