6-bromanyl-2-(2,5-dimethylphenyl)-N-(4-pyrrolidin-1-ylcarbonylphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(2,5-dimethylphenyl)-N-(4-pyrrolidin-1-ylcarbonylphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-2-(2,5-dimethylphenyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]quinoline-4-carboxamide CAS Name: 6-bromo-2-(2,5-dimethylphenyl)-N-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(2,5-dimethylphenyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]quinoline-4-carboxamide Traditional Name: 6-bromo-2-(2,5-dimethylphenyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]cinchoninamide Formula: C29H26BrN3O2 MolecularWeight: 528.43964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=CC=C(C=C4)C(=O)N5CCCC5

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=CC=C(C=C4)C(=O)N5CCCC5

InChI

InChI=1S/C29H26BrN3O2/c1-18-5-6-19(2)23(15-18)27-17-25(24-16-21(30)9-12-26(24)32-27)28(34)31-22-10-7-20(8-11-22)29(35)33-13-3-4-14-33/h5-12,15-17H,3-4,13-14H2,1-2H3,(H,31,34)