2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)thiazol-2-yl]quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)-2-thiazolyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)thiazol-2-yl]cinchoninamide Formula: C27H20FN3OS MolecularWeight: 453.530603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)F)C

InChI

InChI=1S/C27H20FN3OS/c1-16-7-8-19(13-17(16)2)24-14-22(21-5-3-4-6-23(21)29-24)26(32)31-27-30-25(15-33-27)18-9-11-20(28)12-10-18/h3-15H,1-2H3,(H,30,31,32)