5-(isoquinolin-5-yloxymethyl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(isoquinolin-5-yloxymethyl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(5-isoquinolyloxymethyl)-N-[(1R)-1-methyl-2-(3-pyridyl)ethyl]isoxazole-3-carboxamide CAS Name: 5-(5-isoquinolinyloxymethyl)-N-[(2R)-1-(3-pyridinyl)propan-2-yl]-3-isoxazolecarboxamide IUPAC Name: 5-(isoquinolin-5-yloxymethyl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(5-isoquinolyloxymethyl)-N-[(1R)-1-methyl-2-(3-pyridyl)ethyl]isoxazole-3-carboxamide Formula: C22H20N4O3 MolecularWeight: 388.4192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CN=CC=C1)NC(=O)C2=NOC(=C2)COC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C[C@H](CC1=CN=CC=C1)NC(=O)C2=NOC(=C2)COC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C22H20N4O3/c1-15(10-16-4-3-8-23-12-16)25-22(27)20-11-18(29-26-20)14-28-21-6-2-5-17-13-24-9-7-19(17)21/h2-9,11-13,15H,10,14H2,1H3,(H,25,27)/t15-/m1/s1