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

Systemtic Name: N-(3,4-dimethylphenyl)-4-(5-fluoranyl-2-quinolin-2-yl-1H-indol-3-yl)butanamide Openeye Name: N-(3,4-dimethylphenyl)-4-[5-fluoro-2-(2-quinolyl)-1H-indol-3-yl]butanamide CAS Name: N-(3,4-dimethylphenyl)-4-[5-fluoro-2-(2-quinolinyl)-1H-indol-3-yl]butanamide IUPAC Name: N-(3,4-dimethylphenyl)-4-(5-fluoro-2-quinolin-2-yl-1H-indol-3-yl)butanamide Traditional Name: N-(3,4-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=C(C=C1)NC(=O)CCCC2=C(NC3=C2C=C(C=C3)F)C4=NC5=CC=CC=C5C=C4)C

Isomeric SMILES

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

InChI

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