N-(2,3-dimethylphenyl)-4-(5-fluoranyl-2-quinolin-2-yl-1H-indol-3-yl)butanamide

Systemtic Name: N-(2,3-dimethylphenyl)-4-(5-fluoranyl-2-quinolin-2-yl-1H-indol-3-yl)butanamide Openeye Name: N-(2,3-dimethylphenyl)-4-[5-fluoro-2-(2-quinolyl)-1H-indol-3-yl]butanamide CAS Name: N-(2,3-dimethylphenyl)-4-[5-fluoro-2-(2-quinolinyl)-1H-indol-3-yl]butanamide IUPAC Name: N-(2,3-dimethylphenyl)-4-(5-fluoro-2-quinolin-2-yl-1H-indol-3-yl)butanamide Traditional Name: N-(2,3-dimethylphenyl)-4-[5-fluoro-2-(2-quinolyl)-1H-indol-3-yl]butyramide Formula: C29H26FN3O MolecularWeight: 451.534643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CCCC2=C(NC3=C2C=C(C=C3)F)C4=NC5=CC=CC=C5C=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CCCC2=C(NC3=C2C=C(C=C3)F)C4=NC5=CC=CC=C5C=C4)C

InChI

InChI=1S/C29H26FN3O/c1-18-7-5-11-24(19(18)2)32-28(34)12-6-9-22-23-17-21(30)14-16-26(23)33-29(22)27-15-13-20-8-3-4-10-25(20)31-27/h3-5,7-8,10-11,13-17,33H,6,9,12H2,1-2H3,(H,32,34)