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

Systemtic Name: N-(benzimidazol-1-yl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide Openeye Name: N-(benzimidazol-1-yl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide CAS Name: N-(1-benzimidazolyl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide IUPAC Name: N-(benzimidazol-1-yl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide Traditional Name: N-(benzimidazol-1-yl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidaz[1,5-a]azepine-1-carboxamide Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N=C(N2CC1)C3=CC=CC=C3)C(=O)NN4C=NC5=CC=CC=C54

Isomeric SMILES

C1CCC2=C(N=C(N2CC1)C3=CC=CC=C3)C(=O)NN4C=NC5=CC=CC=C54

InChI

InChI=1S/C22H21N5O/c28-22(25-27-15-23-17-11-6-7-12-18(17)27)20-19-13-5-2-8-14-26(19)21(24-20)16-9-3-1-4-10-16/h1,3-4,6-7,9-12,15H,2,5,8,13-14H2,(H,25,28)