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

Systemtic Name: N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[4-(4-isobutylphenyl)thiazol-2-yl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[4-[4-(2-methylpropyl)phenyl]-2-thiazolyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[4-(4-isobutylphenyl)thiazol-2-yl]-2-phenyl-cinchoninamide Formula: C29H25N3OS MolecularWeight: 463.5933

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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

Isomeric SMILES

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

InChI

InChI=1S/C29H25N3OS/c1-19(2)16-20-12-14-22(15-13-20)27-18-34-29(31-27)32-28(33)24-17-26(21-8-4-3-5-9-21)30-25-11-7-6-10-23(24)25/h3-15,17-19H,16H2,1-2H3,(H,31,32,33)