N-tert-butyl-2-[4-[(6-fluoranylquinolin-8-yl)methyl]-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[(6-fluoranylquinolin-8-yl)methyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[(6-fluoro-8-quinolyl)methyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[(6-fluoro-8-quinolinyl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-tert-butyl-2-[4-[(6-fluoroquinolin-8-yl)methyl]-1,4-diazepan-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[(6-fluoro-8-quinolyl)methyl]-1,4-diazepan-1-yl]acetamide Formula: C21H29FN4O MolecularWeight: 372.479563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCCN(CC1)CC2=C3C(=CC(=C2)F)C=CC=N3

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCCN(CC1)CC2=C3C(=CC(=C2)F)C=CC=N3

InChI

InChI=1S/C21H29FN4O/c1-21(2,3)24-19(27)15-26-9-5-8-25(10-11-26)14-17-13-18(22)12-16-6-4-7-23-20(16)17/h4,6-7,12-13H,5,8-11,14-15H2,1-3H3,(H,24,27)