3-phenyl-N-(2-pyridin-2-ylethyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide

Systemtic Name: 3-phenyl-N-(2-pyridin-2-ylethyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide Openeye Name: 3-phenyl-N-[2-(2-pyridyl)ethyl]-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide CAS Name: 3-phenyl-N-[2-(2-pyridinyl)ethyl]-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide IUPAC Name: 3-phenyl-N-(2-pyridin-2-ylethyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide Traditional Name: 3-phenyl-N-[2-(2-pyridyl)ethyl]-6,7,8,9-tetrahydro-5H-imidaz[1,5-a]azepine-1-carboxamide Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N=C(N2CC1)C3=CC=CC=C3)C(=O)NCCC4=CC=CC=N4

Isomeric SMILES

C1CCC2=C(N=C(N2CC1)C3=CC=CC=C3)C(=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C22H24N4O/c27-22(24-15-13-18-11-6-7-14-23-18)20-19-12-5-2-8-16-26(19)21(25-20)17-9-3-1-4-10-17/h1,3-4,6-7,9-11,14H,2,5,8,12-13,15-16H2,(H,24,27)