N-[(1R)-1-(6-bromanyl-1H-benzimidazol-2-yl)-2-oxidanyl-ethyl]-3-methyl-4-(3-oxidanylidenemorpholin-4-yl)benzamide

Systemtic Name: N-[(1R)-1-(6-bromanyl-1H-benzimidazol-2-yl)-2-oxidanyl-ethyl]-3-methyl-4-(3-oxidanylidenemorpholin-4-yl)benzamide Openeye Name: N-[(1R)-1-(6-bromo-1H-benzimidazol-2-yl)-2-hydroxy-ethyl]-3-methyl-4-(3-oxomorpholin-4-yl)benzamide CAS Name: N-[(1R)-1-(6-bromo-1H-benzimidazol-2-yl)-2-hydroxyethyl]-3-methyl-4-(3-oxo-4-morpholinyl)benzamide IUPAC Name: N-[(1R)-1-(6-bromo-1H-benzimidazol-2-yl)-2-hydroxyethyl]-3-methyl-4-(3-oxomorpholin-4-yl)benzamide Traditional Name: N-[(1R)-1-(6-bromo-1H-benzimidazol-2-yl)-2-hydroxy-ethyl]-4-(3-ketomorpholino)-3-methyl-benzamide Formula: C21H21BrN4O4 MolecularWeight: 473.31984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC(CO)C2=NC3=C(N2)C=C(C=C3)Br)N4CCOCC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N[C@@H](CO)C2=NC3=C(N2)C=C(C=C3)Br)N4CCOCC4=O

InChI

InChI=1S/C21H21BrN4O4/c1-12-8-13(2-5-18(12)26-6-7-30-11-19(26)28)21(29)25-17(10-27)20-23-15-4-3-14(22)9-16(15)24-20/h2-5,8-9,17,27H,6-7,10-11H2,1H3,(H,23,24)(H,25,29)/t17-/m0/s1