4-(5-morpholin-4-ylpyridin-2-yl)-N-[(1R,3S)-5-oxidanyl-2-adamantyl]-2,3-dihydroquinoxaline-1-carboxamide

Systemtic Name: 4-(5-morpholin-4-ylpyridin-2-yl)-N-[(1R,3S)-5-oxidanyl-2-adamantyl]-2,3-dihydroquinoxaline-1-carboxamide Openeye Name: N-[(1R,3S)-5-hydroxy-2-adamantyl]-4-(5-morpholino-2-pyridyl)-2,3-dihydroquinoxaline-1-carboxamide CAS Name: N-[(1R,3S)-5-hydroxy-2-adamantyl]-4-[5-(4-morpholinyl)-2-pyridinyl]-2,3-dihydroquinoxaline-1-carboxamide IUPAC Name: N-[(1R,3S)-5-hydroxy-2-adamantyl]-4-(5-morpholin-4-ylpyridin-2-yl)-2,3-dihydroquinoxaline-1-carboxamide Traditional Name: N-[(1R,3S)-5-hydroxy-2-adamantyl]-4-(5-morpholino-2-pyridyl)-2,3-dihydroquinoxaline-1-carboxamide Formula: C28H35N5O3 MolecularWeight: 489.6092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2N1C3=NC=C(C=C3)N4CCOCC4)C(=O)NC5C6CC7CC5CC(C7)(C6)O

Isomeric SMILES

C1CN(C2=CC=CC=C2N1C3=NC=C(C=C3)N4CCOCC4)C(=O)NC5[C@@H]6CC7C[C@H]5CC(C6)(C7)O

InChI

InChI=1S/C28H35N5O3/c34-27(30-26-20-13-19-14-21(26)17-28(35,15-19)16-20)33-8-7-32(23-3-1-2-4-24(23)33)25-6-5-22(18-29-25)31-9-11-36-12-10-31/h1-6,18-21,26,35H,7-17H2,(H,30,34)/t19?,20-,21+,26?,28?