N-(1-azanylisoquinolin-6-yl)-2-[4-(4-methylphenyl)morpholin-2-yl]-2-oxidanyl-ethanamide

Systemtic Name: N-(1-azanylisoquinolin-6-yl)-2-[4-(4-methylphenyl)morpholin-2-yl]-2-oxidanyl-ethanamide Openeye Name: N-(1-amino-6-isoquinolyl)-2-hydroxy-2-[4-(p-tolyl)morpholin-2-yl]acetamide CAS Name: N-(1-amino-6-isoquinolinyl)-2-hydroxy-2-[4-(4-methylphenyl)-2-morpholinyl]acetamide IUPAC Name: N-(1-aminoisoquinolin-6-yl)-2-hydroxy-2-[4-(4-methylphenyl)morpholin-2-yl]acetamide Traditional Name: N-(1-amino-6-isoquinolyl)-2-hydroxy-2-[4-(p-tolyl)morpholin-2-yl]acetamide Formula: C22H24N4O3 MolecularWeight: 392.45096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCOC(C2)C(C(=O)NC3=CC4=C(C=C3)C(=NC=C4)N)O

Isomeric SMILES

CC1=CC=C(C=C1)N2CCOC(C2)C(C(=O)NC3=CC4=C(C=C3)C(=NC=C4)N)O

InChI

InChI=1S/C22H24N4O3/c1-14-2-5-17(6-3-14)26-10-11-29-19(13-26)20(27)22(28)25-16-4-7-18-15(12-16)8-9-24-21(18)23/h2-9,12,19-20,27H,10-11,13H2,1H3,(H2,23,24)(H,25,28)