2-[2-butoxy-5-(tert-butylsulfamoyl)phenyl]-4-oxidanylidene-1H-quinazoline-6-carboxylic acid

Systemtic Name: 2-[2-butoxy-5-(tert-butylsulfamoyl)phenyl]-4-oxidanylidene-1H-quinazoline-6-carboxylic acid Openeye Name: 2-[2-butoxy-5-(tert-butylsulfamoyl)phenyl]-4-oxo-1H-quinazoline-6-carboxylic acid CAS Name: 2-[2-butoxy-5-(tert-butylsulfamoyl)phenyl]-4-oxo-1H-quinazoline-6-carboxylic acid IUPAC Name: 2-[2-butoxy-5-(tert-butylsulfamoyl)phenyl]-4-oxo-1H-quinazoline-6-carboxylic acid Traditional Name: 2-[2-butoxy-5-(tert-butylsulfamoyl)phenyl]-4-keto-1H-quinazoline-6-carboxylic acid Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)S(=O)(=O)NC(C)(C)C)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)S(=O)(=O)NC(C)(C)C)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C23H27N3O6S/c1-5-6-11-32-19-10-8-15(33(30,31)26-23(2,3)4)13-17(19)20-24-18-9-7-14(22(28)29)12-16(18)21(27)25-20/h7-10,12-13,26H,5-6,11H2,1-4H3,(H,28,29)(H,24,25,27)