N-cyclobutyl-3-(4-fluorophenyl)carbonyl-2-methyl-2,6-dihydro-1H-azepino[4,5-b]indole-5-carboxamide

Systemtic Name: N-cyclobutyl-3-(4-fluorophenyl)carbonyl-2-methyl-2,6-dihydro-1H-azepino[4,5-b]indole-5-carboxamide Openeye Name: N-cyclobutyl-3-(4-fluorobenzoyl)-2-methyl-2,6-dihydro-1H-azepino[4,5-b]indole-5-carboxamide CAS Name: N-cyclobutyl-3-[(4-fluorophenyl)-oxomethyl]-2-methyl-2,6-dihydro-1H-azepino[4,5-b]indole-5-carboxamide IUPAC Name: N-cyclobutyl-3-(4-fluorobenzoyl)-2-methyl-2,6-dihydro-1H-azepino[4,5-b]indole-5-carboxamide Traditional Name: N-cyclobutyl-3-(4-fluorobenzoyl)-2-methyl-2,6-dihydro-1H-azepin[4,5-b]indole-5-carboxamide Formula: C25H24FN3O2 MolecularWeight: 417.475363

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C(=CN1C(=O)C3=CC=C(C=C3)F)C(=O)NC4CCC4)NC5=CC=CC=C25

Isomeric SMILES

CC1CC2=C(C(=CN1C(=O)C3=CC=C(C=C3)F)C(=O)NC4CCC4)NC5=CC=CC=C25

InChI

InChI=1S/C25H24FN3O2/c1-15-13-20-19-7-2-3-8-22(19)28-23(20)21(24(30)27-18-5-4-6-18)14-29(15)25(31)16-9-11-17(26)12-10-16/h2-3,7-12,14-15,18,28H,4-6,13H2,1H3,(H,27,30)