6-bromanyl-N-[3-cyano-4-(4-ethylphenyl)-5-methyl-thiophen-2-yl]-2-(2,5-dimethylphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[3-cyano-4-(4-ethylphenyl)-5-methyl-thiophen-2-yl]-2-(2,5-dimethylphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[3-cyano-4-(4-ethylphenyl)-5-methyl-2-thienyl]-2-(2,5-dimethylphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[3-cyano-4-(4-ethylphenyl)-5-methyl-2-thiophenyl]-2-(2,5-dimethylphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]-2-(2,5-dimethylphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-[3-cyano-4-(4-ethylphenyl)-5-methyl-2-thienyl]-2-(2,5-dimethylphenyl)cinchoninamide Formula: C32H26BrN3OS MolecularWeight: 580.53734

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(SC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=C(C=CC(=C5)C)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(SC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=C(C=CC(=C5)C)C)C

InChI

InChI=1S/C32H26BrN3OS/c1-5-21-8-10-22(11-9-21)30-20(4)38-32(27(30)17-34)36-31(37)26-16-29(24-14-18(2)6-7-19(24)3)35-28-13-12-23(33)15-25(26)28/h6-16H,5H2,1-4H3,(H,36,37)