2-(3-bromanyl-1-adamantyl)-N-[4-(1-methylimidazol-2-yl)carbonylphenyl]ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-[4-(1-methylimidazol-2-yl)carbonylphenyl]ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-[4-(1-methylimidazole-2-carbonyl)phenyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-[4-[(1-methyl-2-imidazolyl)-oxomethyl]phenyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-[4-(1-methylimidazole-2-carbonyl)phenyl]acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-[4-(1-methylimidazole-2-carbonyl)phenyl]acetamide Formula: C23H26BrN3O2 MolecularWeight: 456.37544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26BrN3O2/c1-27-7-6-25-21(27)20(29)17-2-4-18(5-3-17)26-19(28)13-22-9-15-8-16(10-22)12-23(24,11-15)14-22/h2-7,15-16H,8-14H2,1H3,(H,26,28)