N-[(2R)-1-imidazol-1-yl-3,3-dimethyl-butan-2-yl]-5-(isoquinolin-5-yloxymethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(2R)-1-imidazol-1-yl-3,3-dimethyl-butan-2-yl]-5-(isoquinolin-5-yloxymethyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[(1R)-1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]-5-(5-isoquinolyloxymethyl)isoxazole-3-carboxamide CAS Name: N-[(2R)-1-(1-imidazolyl)-3,3-dimethylbutan-2-yl]-5-(5-isoquinolinyloxymethyl)-3-isoxazolecarboxamide IUPAC Name: N-[(2R)-1-imidazol-1-yl-3,3-dimethylbutan-2-yl]-5-(isoquinolin-5-yloxymethyl)-1,2-oxazole-3-carboxamide Traditional Name: N-[(1R)-1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]-5-(5-isoquinolyloxymethyl)isoxazole-3-carboxamide Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C=CN=C1)NC(=O)C2=NOC(=C2)COC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC(C)(C)[C@H](CN1C=CN=C1)NC(=O)C2=NOC(=C2)COC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C23H25N5O3/c1-23(2,3)21(13-28-10-9-25-15-28)26-22(29)19-11-17(31-27-19)14-30-20-6-4-5-16-12-24-8-7-18(16)20/h4-12,15,21H,13-14H2,1-3H3,(H,26,29)/t21-/m0/s1