6-bromanyl-N-(3-cyanothiophen-2-yl)-2-(4-methylphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-(3-cyanothiophen-2-yl)-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-(3-cyano-2-thienyl)-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-(3-cyano-2-thiophenyl)-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-(3-cyanothiophen-2-yl)-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-(3-cyano-2-thienyl)-2-(p-tolyl)cinchoninamide Formula: C22H14BrN3OS MolecularWeight: 448.33506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C=CS4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C=CS4)C#N

InChI

InChI=1S/C22H14BrN3OS/c1-13-2-4-14(5-3-13)20-11-18(17-10-16(23)6-7-19(17)25-20)21(27)26-22-15(12-24)8-9-28-22/h2-11H,1H3,(H,26,27)