4-bromanyl-2-fluoranyl-6-methyl-3-(pyrrolidin-1-ylmethyl)-N-quinolin-7-yl-benzamide

Systemtic Name: 4-bromanyl-2-fluoranyl-6-methyl-3-(pyrrolidin-1-ylmethyl)-N-quinolin-7-yl-benzamide Openeye Name: 4-bromo-2-fluoro-6-methyl-3-(pyrrolidin-1-ylmethyl)-N-(7-quinolyl)benzamide CAS Name: 4-bromo-2-fluoro-6-methyl-3-(1-pyrrolidinylmethyl)-N-(7-quinolinyl)benzamide IUPAC Name: 4-bromo-2-fluoro-6-methyl-3-(pyrrolidin-1-ylmethyl)-N-quinolin-7-ylbenzamide Traditional Name: 4-bromo-2-fluoro-6-methyl-3-(pyrrolidinomethyl)-N-(7-quinolyl)benzamide Formula: C22H21BrFN3O MolecularWeight: 442.324043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)NC2=CC3=C(C=CC=N3)C=C2)F)CN4CCCC4)Br

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)NC2=CC3=C(C=CC=N3)C=C2)F)CN4CCCC4)Br

InChI

InChI=1S/C22H21BrFN3O/c1-14-11-18(23)17(13-27-9-2-3-10-27)21(24)20(14)22(28)26-16-7-6-15-5-4-8-25-19(15)12-16/h4-8,11-12H,2-3,9-10,13H2,1H3,(H,26,28)