[6-methoxy-7-(3-methylsulfonylpropoxy)-4-oxidanylidene-quinazolin-3-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [6-methoxy-7-(3-methylsulfonylpropoxy)-4-oxidanylidene-quinazolin-3-yl]methyl 2,2-dimethylpropanoate Openeye Name: [6-methoxy-7-(3-methylsulfonylpropoxy)-4-oxo-quinazolin-3-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [6-methoxy-7-(3-methylsulfonylpropoxy)-4-oxo-3-quinazolinyl]methyl ester IUPAC Name: [6-methoxy-7-(3-methylsulfonylpropoxy)-4-oxoquinazolin-3-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-keto-7-(3-mesylpropoxy)-6-methoxy-quinazolin-3-yl]methyl ester Formula: C19H26N2O7S MolecularWeight: 426.48394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=NC2=CC(=C(C=C2C1=O)OC)OCCCS(=O)(=O)C

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=NC2=CC(=C(C=C2C1=O)OC)OCCCS(=O)(=O)C

InChI

InChI=1S/C19H26N2O7S/c1-19(2,3)18(23)28-12-21-11-20-14-10-16(27-7-6-8-29(5,24)25)15(26-4)9-13(14)17(21)22/h9-11H,6-8,12H2,1-5H3