2-(3-bromanyl-1-adamantyl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-[(1-methyl-2-imidazolyl)-phenylmethyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]acetamide Formula: C23H28BrN3O MolecularWeight: 442.39192

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C23H28BrN3O/c1-27-8-7-25-21(27)20(18-5-3-2-4-6-18)26-19(28)14-22-10-16-9-17(11-22)13-23(24,12-16)15-22/h2-8,16-17,20H,9-15H2,1H3,(H,26,28)