2-[(1R)-1-cyano-2-[4-(diethylsulfamoyl)phenyl]-2-oxidanylidene-ethyl]-6-methyl-quinazolin-4-olate

Systemtic Name: 2-[(1R)-1-cyano-2-[4-(diethylsulfamoyl)phenyl]-2-oxidanylidene-ethyl]-6-methyl-quinazolin-4-olate Openeye Name: 2-[(1R)-1-cyano-2-[4-(diethylsulfamoyl)phenyl]-2-oxo-ethyl]-6-methyl-quinazolin-4-olate CAS Name: 2-[(1R)-1-cyano-2-[4-(diethylsulfamoyl)phenyl]-2-oxoethyl]-6-methyl-4-quinazolinolate IUPAC Name: 2-[(1R)-1-cyano-2-[4-(diethylsulfamoyl)phenyl]-2-oxoethyl]-6-methylquinazolin-4-olate Traditional Name: 2-[(1R)-1-cyano-2-[4-(diethylsulfamoyl)phenyl]-2-keto-ethyl]-6-methyl-quinazolin-4-olate Formula: C22H21N4O4S- MolecularWeight: 437.49154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)C(C#N)C2=NC3=C(C=C(C=C3)C)C(=N2)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)[C@H](C#N)C2=NC3=C(C=C(C=C3)C)C(=N2)[O-]

InChI

InChI=1S/C22H22N4O4S/c1-4-26(5-2)31(29,30)16-9-7-15(8-10-16)20(27)18(13-23)21-24-19-11-6-14(3)12-17(19)22(28)25-21/h6-12,18H,4-5H2,1-3H3,(H,24,25,28)/p-1/t18-/m0/s1