2-(5-bromanylthiophen-2-yl)-N-[(4-ethoxyphenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(5-bromanylthiophen-2-yl)-N-[(4-ethoxyphenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(5-bromo-2-thienyl)-N-[(4-ethoxyphenyl)methyl]quinoline-4-carboxamide CAS Name: 2-(5-bromo-2-thiophenyl)-N-[(4-ethoxyphenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(5-bromothiophen-2-yl)-N-[(4-ethoxyphenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-(5-bromo-2-thienyl)-N-(4-ethoxybenzyl)cinchoninamide Formula: C23H19BrN2O2S MolecularWeight: 467.37816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Br

InChI

InChI=1S/C23H19BrN2O2S/c1-2-28-16-9-7-15(8-10-16)14-25-23(27)18-13-20(21-11-12-22(24)29-21)26-19-6-4-3-5-17(18)19/h3-13H,2,14H2,1H3,(H,25,27)