5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(3-methylpyridin-4-yl)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(3-methylpyridin-4-yl)methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(3-methyl-4-pyridyl)methyl]isoxazole-3-carboxamide CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(3-methyl-4-pyridinyl)methyl]-3-isoxazolecarboxamide IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(3-methylpyridin-4-yl)methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(3-methyl-4-pyridyl)methyl]isoxazole-3-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)CNC(=O)C2=NOC(=C2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C=CN=C1)CNC(=O)C2=NOC(=C2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H22N4O2/c1-15-11-22-8-6-17(15)12-23-21(26)20-10-19(27-24-20)14-25-9-7-16-4-2-3-5-18(16)13-25/h2-6,8,10-11H,7,9,12-14H2,1H3,(H,23,26)