2-(1-azanylisoquinolin-7-yl)oxy-N-[4-(2-methylsulfonylphenyl)phenyl]ethanamide

Systemtic Name: 2-(1-azanylisoquinolin-7-yl)oxy-N-[4-(2-methylsulfonylphenyl)phenyl]ethanamide Openeye Name: 2-[(1-amino-7-isoquinolyl)oxy]-N-[4-(2-methylsulfonylphenyl)phenyl]acetamide CAS Name: 2-[(1-amino-7-isoquinolinyl)oxy]-N-[4-(2-methylsulfonylphenyl)phenyl]acetamide IUPAC Name: 2-(1-aminoisoquinolin-7-yl)oxy-N-[4-(2-methylsulfonylphenyl)phenyl]acetamide Traditional Name: 2-[(1-amino-7-isoquinolyl)oxy]-N-[4-(2-mesylphenyl)phenyl]acetamide Formula: C24H21N3O4S MolecularWeight: 447.50624

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)NC(=O)COC3=CC4=C(C=C3)C=CN=C4N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)NC(=O)COC3=CC4=C(C=C3)C=CN=C4N

InChI

InChI=1S/C24H21N3O4S/c1-32(29,30)22-5-3-2-4-20(22)16-6-9-18(10-7-16)27-23(28)15-31-19-11-8-17-12-13-26-24(25)21(17)14-19/h2-14H,15H2,1H3,(H2,25,26)(H,27,28)