8-chloranyl-2-(4-ethylphenyl)-N-[(Z)-1-thiophen-2-ylpropylideneamino]quinoline-4-carboxamide

Systemtic Name: 8-chloranyl-2-(4-ethylphenyl)-N-[(Z)-1-thiophen-2-ylpropylideneamino]quinoline-4-carboxamide Openeye Name: 8-chloro-2-(4-ethylphenyl)-N-[(Z)-1-(2-thienyl)propylideneamino]quinoline-4-carboxamide CAS Name: 8-chloro-2-(4-ethylphenyl)-N-[(Z)-1-thiophen-2-ylpropylideneamino]-4-quinolinecarboxamide IUPAC Name: 8-chloro-2-(4-ethylphenyl)-N-[(Z)-1-thiophen-2-ylpropylideneamino]quinoline-4-carboxamide Traditional Name: 8-chloro-2-(4-ethylphenyl)-N-[(Z)-1-(2-thienyl)propylideneamino]cinchoninamide Formula: C25H22ClN3OS MolecularWeight: 447.97968

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=C(C=CC=C3Cl)C(=C2)C(=O)NN=C(CC)C4=CC=CS4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=C(C=CC=C3Cl)C(=C2)C(=O)N/N=C(/CC)\C4=CC=CS4

InChI

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