2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)-5-methyl-thiazol-2-yl]quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)-5-methyl-2-thiazolyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-N-[4-(4-fluorophenyl)-5-methyl-thiazol-2-yl]cinchoninamide Formula: C28H22FN3OS MolecularWeight: 467.557183

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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(=C(S4)C)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(=C(S4)C)C5=CC=C(C=C5)F)C

InChI

InChI=1S/C28H22FN3OS/c1-16-8-9-20(14-17(16)2)25-15-23(22-6-4-5-7-24(22)30-25)27(33)32-28-31-26(18(3)34-28)19-10-12-21(29)13-11-19/h4-15H,1-3H3,(H,31,32,33)