2-(3-bromophenyl)-N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-(3-bromophenyl)-N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]quinoline-4-carboxamide Openeye Name: 2-(3-bromophenyl)-N-[4-(4-isobutylphenyl)thiazol-2-yl]quinoline-4-carboxamide CAS Name: 2-(3-bromophenyl)-N-[4-[4-(2-methylpropyl)phenyl]-2-thiazolyl]-4-quinolinecarboxamide IUPAC Name: 2-(3-bromophenyl)-N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]quinoline-4-carboxamide Traditional Name: 2-(3-bromophenyl)-N-[4-(4-isobutylphenyl)thiazol-2-yl]cinchoninamide Formula: C29H24BrN3OS MolecularWeight: 542.48936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)Br

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)Br

InChI

InChI=1S/C29H24BrN3OS/c1-18(2)14-19-10-12-20(13-11-19)27-17-35-29(32-27)33-28(34)24-16-26(21-6-5-7-22(30)15-21)31-25-9-4-3-8-23(24)25/h3-13,15-18H,14H2,1-2H3,(H,32,33,34)