2-(1-azanylisoquinolin-7-yl)oxy-3-methyl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide

Systemtic Name: 2-(1-azanylisoquinolin-7-yl)oxy-3-methyl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide Openeye Name: 2-[(1-amino-7-isoquinolyl)oxy]-3-methyl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide CAS Name: 2-[(1-amino-7-isoquinolinyl)oxy]-3-methyl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide IUPAC Name: 2-(1-aminoisoquinolin-7-yl)oxy-3-methyl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide Traditional Name: 2-[(1-amino-7-isoquinolyl)oxy]-3-methyl-N-[4-(2-sulfamoylphenyl)phenyl]butyramide Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)N)OC3=CC4=C(C=C3)C=CN=C4N

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)N)OC3=CC4=C(C=C3)C=CN=C4N

InChI

InChI=1S/C26H26N4O4S/c1-16(2)24(34-20-12-9-18-13-14-29-25(27)22(18)15-20)26(31)30-19-10-7-17(8-11-19)21-5-3-4-6-23(21)35(28,32)33/h3-16,24H,1-2H3,(H2,27,29)(H,30,31)(H2,28,32,33)