2-(4-bromophenyl)-N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-(4-bromophenyl)-N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)cinchoninamide Formula: C24H18BrN3OS MolecularWeight: 476.38822

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C24H18BrN3OS/c1-3-17-14(2)30-24(20(17)13-26)28-23(29)19-12-22(15-8-10-16(25)11-9-15)27-21-7-5-4-6-18(19)21/h4-12H,3H2,1-2H3,(H,28,29)