N-[3-[(5-bromanyl-2-morpholin-4-yl-phenyl)amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[(5-bromanyl-2-morpholin-4-yl-phenyl)amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-(5-bromo-2-morpholino-anilino)-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[5-bromo-2-(4-morpholinyl)anilino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-(5-bromo-2-morpholin-4-ylanilino)-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-(5-bromo-2-morpholino-anilino)-3-keto-propyl]adamantane-1-carboxamide Formula: C24H32BrN3O3 MolecularWeight: 490.43318

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)Br)NC(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)Br)NC(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H32BrN3O3/c25-19-1-2-21(28-5-7-31-8-6-28)20(12-19)27-22(29)3-4-26-23(30)24-13-16-9-17(14-24)11-18(10-16)15-24/h1-2,12,16-18H,3-11,13-15H2,(H,26,30)(H,27,29)