N-[[4-(5-tert-butyl-1H-imidazol-2-yl)phenyl]methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[[4-(5-tert-butyl-1H-imidazol-2-yl)phenyl]methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]-2-phenoxy-ethanamide Openeye Name: N-[[4-(5-tert-butyl-1H-imidazol-2-yl)phenyl]methyl]-N-[(3S)-2-oxoazepan-3-yl]-2-phenoxy-acetamide CAS Name: N-[[4-(5-tert-butyl-1H-imidazol-2-yl)phenyl]methyl]-N-[(3S)-2-oxo-3-azepanyl]-2-phenoxyacetamide IUPAC Name: N-[[4-(5-tert-butyl-1H-imidazol-2-yl)phenyl]methyl]-N-[(3S)-2-oxoazepan-3-yl]-2-phenoxyacetamide Traditional Name: N-[4-(5-tert-butyl-1H-imidazol-2-yl)benzyl]-N-[(3S)-2-ketoazepan-3-yl]-2-phenoxy-acetamide Formula: C28H34N4O3 MolecularWeight: 474.59456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CN=C(N1)C2=CC=C(C=C2)CN(C3CCCCNC3=O)C(=O)COC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CN=C(N1)C2=CC=C(C=C2)CN([C@H]3CCCCNC3=O)C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C28H34N4O3/c1-28(2,3)24-17-30-26(31-24)21-14-12-20(13-15-21)18-32(23-11-7-8-16-29-27(23)34)25(33)19-35-22-9-5-4-6-10-22/h4-6,9-10,12-15,17,23H,7-8,11,16,18-19H2,1-3H3,(H,29,34)(H,30,31)/t23-/m0/s1