N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]-2-(2-methylpropyl)quinoline-4-carboxamide

Systemtic Name: N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]-2-(2-methylpropyl)quinoline-4-carboxamide Openeye Name: N-[(E)-(5-ethyl-2-thienyl)methyleneamino]-2-isobutyl-quinoline-4-carboxamide CAS Name: N-[(E)-(5-ethyl-2-thiophenyl)methylideneamino]-2-(2-methylpropyl)-4-quinolinecarboxamide IUPAC Name: N-[(E)-(5-ethylthiophen-2-yl)methylideneamino]-2-(2-methylpropyl)quinoline-4-carboxamide Traditional Name: N-[(E)-(5-ethyl-2-thienyl)methyleneamino]-2-isobutyl-cinchoninamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C=NNC(=O)C2=CC(=NC3=CC=CC=C32)CC(C)C

Isomeric SMILES

CCC1=CC=C(S1)/C=N/NC(=O)C2=CC(=NC3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C21H23N3OS/c1-4-16-9-10-17(26-16)13-22-24-21(25)19-12-15(11-14(2)3)23-20-8-6-5-7-18(19)20/h5-10,12-14H,4,11H2,1-3H3,(H,24,25)/b22-13+