2-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-4-oxidanylidene-1H-quinazoline-6-carboxylic acid

Systemtic Name: 2-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-4-oxidanylidene-1H-quinazoline-6-carboxylic acid Openeye Name: 2-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-4-oxo-1H-quinazoline-6-carboxylic acid CAS Name: 2-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4-oxo-1H-quinazoline-6-carboxylic acid IUPAC Name: 2-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4-oxo-1H-quinazoline-6-carboxylic acid Traditional Name: 2-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-4-keto-1H-quinazoline-6-carboxylic acid Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O6S/c1-4-23(5-2)30(27,28)13-7-9-17(29-3)15(11-13)18-21-16-8-6-12(20(25)26)10-14(16)19(24)22-18/h6-11H,4-5H2,1-3H3,(H,25,26)(H,21,22,24)