3-(azepan-1-ylmethyl)-4-bromanyl-2-fluoranyl-6-methyl-5-quinolin-7-yl-benzamide

Systemtic Name: 3-(azepan-1-ylmethyl)-4-bromanyl-2-fluoranyl-6-methyl-5-quinolin-7-yl-benzamide Openeye Name: 3-(azepan-1-ylmethyl)-4-bromo-2-fluoro-6-methyl-5-(7-quinolyl)benzamide CAS Name: 3-(1-azepanylmethyl)-4-bromo-2-fluoro-6-methyl-5-(7-quinolinyl)benzamide IUPAC Name: 3-(azepan-1-ylmethyl)-4-bromo-2-fluoro-6-methyl-5-quinolin-7-ylbenzamide Traditional Name: 3-(azepan-1-ylmethyl)-4-bromo-2-fluoro-6-methyl-5-(7-quinolyl)benzamide Formula: C24H25BrFN3O MolecularWeight: 470.377203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C(=O)N)F)CN2CCCCCC2)Br)C3=CC4=C(C=CC=N4)C=C3

Isomeric SMILES

CC1=C(C(=C(C(=C1C(=O)N)F)CN2CCCCCC2)Br)C3=CC4=C(C=CC=N4)C=C3

InChI

InChI=1S/C24H25BrFN3O/c1-15-20(17-9-8-16-7-6-10-28-19(16)13-17)22(25)18(23(26)21(15)24(27)30)14-29-11-4-2-3-5-12-29/h6-10,13H,2-5,11-12,14H2,1H3,(H2,27,30)