N-[(E)-1-(5-bromanylthiophen-2-yl)propylideneamino]-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(E)-1-(5-bromanylthiophen-2-yl)propylideneamino]-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[(E)-1-(5-bromo-2-thienyl)propylideneamino]-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[(E)-1-(5-bromo-2-thiophenyl)propylideneamino]-2-(2,4-dimethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(E)-1-(5-bromothiophen-2-yl)propylideneamino]-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[(E)-1-(5-bromo-2-thienyl)propylideneamino]-2-(2,4-dimethoxyphenyl)cinchoninamide Formula: C25H22BrN3O3S MolecularWeight: 524.42948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22BrN3O3S/c1-4-19(23-11-12-24(26)33-23)28-29-25(30)18-14-21(27-20-8-6-5-7-16(18)20)17-10-9-15(31-2)13-22(17)32-3/h5-14H,4H2,1-3H3,(H,29,30)/b28-19+