N-(1-methylpyrazol-4-yl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide

Systemtic Name: N-(1-methylpyrazol-4-yl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide Openeye Name: N-(1-methylpyrazol-4-yl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide CAS Name: N-(1-methyl-4-pyrazolyl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide IUPAC Name: N-(1-methylpyrazol-4-yl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide Traditional Name: N-(1-methylpyrazol-4-yl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidaz[1,5-a]azepine-1-carboxamide Formula: C19H21N5O MolecularWeight: 335.40294

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)NC(=O)C2=C3CCCCCN3C(=N2)C4=CC=CC=C4

Isomeric SMILES

CN1C=C(C=N1)NC(=O)C2=C3CCCCCN3C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C19H21N5O/c1-23-13-15(12-20-23)21-19(25)17-16-10-6-3-7-11-24(16)18(22-17)14-8-4-2-5-9-14/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3,(H,21,25)