(4-azanylquinazolin-2-yl)methyl 3,4-dimethyl-5-sulfamoyl-benzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 3,4-dimethyl-5-sulfamoyl-benzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 3,4-dimethyl-5-sulfamoyl-benzoate CAS Name: 3,4-dimethyl-5-sulfamoylbenzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 3,4-dimethyl-5-sulfamoylbenzoate Traditional Name: 3,4-dimethyl-5-sulfamoyl-benzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3C(=N2)N)S(=O)(=O)N)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3C(=N2)N)S(=O)(=O)N)C

InChI

InChI=1S/C18H18N4O4S/c1-10-7-12(8-15(11(10)2)27(20,24)25)18(23)26-9-16-21-14-6-4-3-5-13(14)17(19)22-16/h3-8H,9H2,1-2H3,(H2,19,21,22)(H2,20,24,25)