(5R,7S)-N-(2-methoxydibenzofuran-3-yl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide

Systemtic Name: (5R,7S)-N-(2-methoxydibenzofuran-3-yl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide Openeye Name: (5R,7S)-N-(2-methoxydibenzofuran-3-yl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide CAS Name: (5R,7S)-N-(2-methoxy-3-dibenzofuranyl)-3-(1,2,4-triazol-1-yl)-1-adamantanecarboxamide IUPAC Name: (5R,7S)-N-(2-methoxydibenzofuran-3-yl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide Traditional Name: (5R,7S)-N-(2-methoxydibenzofuran-3-yl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C45CC6CC(C4)CC(C6)(C5)N7C=NC=N7

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C45C[C@H]6C[C@@H](C4)CC(C6)(C5)N7C=NC=N7

InChI

InChI=1S/C26H26N4O3/c1-32-23-7-19-18-4-2-3-5-21(18)33-22(19)8-20(23)29-24(31)25-9-16-6-17(10-25)12-26(11-16,13-25)30-15-27-14-28-30/h2-5,7-8,14-17H,6,9-13H2,1H3,(H,29,31)/t16-,17+,25?,26?