N-(3-aminocarbonylthiophen-2-yl)-2-(3-bromophenyl)quinoline-4-carboxamide

Systemtic Name: N-(3-aminocarbonylthiophen-2-yl)-2-(3-bromophenyl)quinoline-4-carboxamide Openeye Name: 2-(3-bromophenyl)-N-(3-carbamoyl-2-thienyl)quinoline-4-carboxamide CAS Name: 2-(3-bromophenyl)-N-(3-carbamoyl-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(3-bromophenyl)-N-(3-carbamoylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: 2-(3-bromophenyl)-N-(3-carbamoyl-2-thienyl)cinchoninamide Formula: C21H14BrN3O2S MolecularWeight: 452.32376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)NC4=C(C=CS4)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)NC4=C(C=CS4)C(=O)N

InChI

InChI=1S/C21H14BrN3O2S/c22-13-5-3-4-12(10-13)18-11-16(14-6-1-2-7-17(14)24-18)20(27)25-21-15(19(23)26)8-9-28-21/h1-11H,(H2,23,26)(H,25,27)