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

Systemtic Name: 2-(3,4-dichlorophenyl)-N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dichlorophenyl)-N-[4-(4-isobutylphenyl)thiazol-2-yl]quinoline-4-carboxamide CAS Name: 2-(3,4-dichlorophenyl)-N-[4-[4-(2-methylpropyl)phenyl]-2-thiazolyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dichlorophenyl)-N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dichlorophenyl)-N-[4-(4-isobutylphenyl)thiazol-2-yl]cinchoninamide Formula: C29H23Cl2N3OS MolecularWeight: 532.48342

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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(=C(C=C5)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C29H23Cl2N3OS/c1-17(2)13-18-7-9-19(10-8-18)27-16-36-29(33-27)34-28(35)22-15-26(20-11-12-23(30)24(31)14-20)32-25-6-4-3-5-21(22)25/h3-12,14-17H,13H2,1-2H3,(H,33,34,35)