(4-azanylquinazolin-2-yl)methyl 3-(propylsulfamoyl)benzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 3-(propylsulfamoyl)benzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 3-(propylsulfamoyl)benzoate CAS Name: 3-(propylsulfamoyl)benzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 3-(propylsulfamoyl)benzoate Traditional Name: 3-(propylsulfamoyl)benzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C19H20N4O4S MolecularWeight: 400.4515

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3C(=N2)N

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3C(=N2)N

InChI

InChI=1S/C19H20N4O4S/c1-2-10-21-28(25,26)14-7-5-6-13(11-14)19(24)27-12-17-22-16-9-4-3-8-15(16)18(20)23-17/h3-9,11,21H,2,10,12H2,1H3,(H2,20,22,23)