(4-azanylquinazolin-2-yl)methyl 3-[(4-fluorophenyl)sulfamoyl]benzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 3-[(4-fluorophenyl)sulfamoyl]benzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 3-[(4-fluorophenyl)sulfamoyl]benzoate CAS Name: 3-[(4-fluorophenyl)sulfamoyl]benzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 3-[(4-fluorophenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-fluorophenyl)sulfamoyl]benzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C22H17FN4O4S MolecularWeight: 452.458183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=C(C=C4)F)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=C(C=C4)F)N

InChI

InChI=1S/C22H17FN4O4S/c23-15-8-10-16(11-9-15)27-32(29,30)17-5-3-4-14(12-17)22(28)31-13-20-25-19-7-2-1-6-18(19)21(24)26-20/h1-12,27H,13H2,(H2,24,25,26)