N-[2-(5-methyl-1,2-oxazol-3-yl)-1-oxidanylidene-isoquinolin-5-yl]-2-(2-methylphenyl)ethanamide

Systemtic Name: N-[2-(5-methyl-1,2-oxazol-3-yl)-1-oxidanylidene-isoquinolin-5-yl]-2-(2-methylphenyl)ethanamide Openeye Name: N-[2-(5-methylisoxazol-3-yl)-1-oxo-5-isoquinolyl]-2-(o-tolyl)acetamide CAS Name: N-[2-(5-methyl-3-isoxazolyl)-1-oxo-5-isoquinolinyl]-2-(2-methylphenyl)acetamide IUPAC Name: N-[2-(5-methyl-1,2-oxazol-3-yl)-1-oxoisoquinolin-5-yl]-2-(2-methylphenyl)acetamide Traditional Name: N-[1-keto-2-(5-methylisoxazol-3-yl)-5-isoquinolyl]-2-(o-tolyl)acetamide Formula: C22H19N3O3 MolecularWeight: 373.40456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC2=CC=CC3=C2C=CN(C3=O)C4=NOC(=C4)C

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC2=CC=CC3=C2C=CN(C3=O)C4=NOC(=C4)C

InChI

InChI=1S/C22H19N3O3/c1-14-6-3-4-7-16(14)13-21(26)23-19-9-5-8-18-17(19)10-11-25(22(18)27)20-12-15(2)28-24-20/h3-12H,13H2,1-2H3,(H,23,26)