(4-azanylquinazolin-2-yl)methyl 3-methyl-2-(phenylsulfonylamino)butanoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 3-methyl-2-(phenylsulfonylamino)butanoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 2-(benzenesulfonamido)-3-methyl-butanoate CAS Name: 2-(benzenesulfonamido)-3-methylbutanoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 2-(benzenesulfonamido)-3-methylbutanoate Traditional Name: 2-(benzenesulfonamido)-3-methyl-butyric acid (4-aminoquinazolin-2-yl)methyl ester Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=NC2=CC=CC=C2C(=N1)N)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)OCC1=NC2=CC=CC=C2C(=N1)N)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O4S/c1-13(2)18(24-29(26,27)14-8-4-3-5-9-14)20(25)28-12-17-22-16-11-7-6-10-15(16)19(21)23-17/h3-11,13,18,24H,12H2,1-2H3,(H2,21,22,23)