2-(5-bromanylthiophen-2-yl)-N-[2-(2-ethoxyethanoylamino)ethyl]quinoline-4-carboxamide

Systemtic Name: 2-(5-bromanylthiophen-2-yl)-N-[2-(2-ethoxyethanoylamino)ethyl]quinoline-4-carboxamide Openeye Name: 2-(5-bromo-2-thienyl)-N-[2-[(2-ethoxyacetyl)amino]ethyl]quinoline-4-carboxamide CAS Name: 2-(5-bromo-2-thiophenyl)-N-[2-[(2-ethoxy-1-oxoethyl)amino]ethyl]-4-quinolinecarboxamide IUPAC Name: 2-(5-bromothiophen-2-yl)-N-[2-[(2-ethoxyacetyl)amino]ethyl]quinoline-4-carboxamide Traditional Name: 2-(5-bromo-2-thienyl)-N-[2-[(2-ethoxyacetyl)amino]ethyl]cinchoninamide Formula: C20H20BrN3O3S MolecularWeight: 462.3601

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)NCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(S3)Br

Isomeric SMILES

CCOCC(=O)NCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(S3)Br

InChI

InChI=1S/C20H20BrN3O3S/c1-2-27-12-19(25)22-9-10-23-20(26)14-11-16(17-7-8-18(21)28-17)24-15-6-4-3-5-13(14)15/h3-8,11H,2,9-10,12H2,1H3,(H,22,25)(H,23,26)