2-(3-butoxyphenyl)-N-[(E)-(3-methylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(3-butoxyphenyl)-N-[(E)-(3-methylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide Openeye Name: 2-(3-butoxyphenyl)-N-[(E)-(3-methyl-2-thienyl)methyleneamino]quinoline-4-carboxamide CAS Name: 2-(3-butoxyphenyl)-N-[(E)-(3-methyl-2-thiophenyl)methylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(3-butoxyphenyl)-N-[(E)-(3-methylthiophen-2-yl)methylideneamino]quinoline-4-carboxamide Traditional Name: 2-(3-butoxyphenyl)-N-[(E)-(3-methyl-2-thienyl)methyleneamino]cinchoninamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=CC4=C(C=CS4)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N/N=C/C4=C(C=CS4)C

InChI

InChI=1S/C26H25N3O2S/c1-3-4-13-31-20-9-7-8-19(15-20)24-16-22(21-10-5-6-11-23(21)28-24)26(30)29-27-17-25-18(2)12-14-32-25/h5-12,14-17H,3-4,13H2,1-2H3,(H,29,30)/b27-17+