1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-(methylsulfonylmethyl)benzoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-(methylsulfonylmethyl)benzoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CC(=CC=C3)CS(=O)(=O)C

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CC(=CC=C3)CS(=O)(=O)C

InChI

InChI=1S/C19H18N2O5S/c1-12(17-20-16-9-4-3-8-15(16)18(22)21-17)26-19(23)14-7-5-6-13(10-14)11-27(2,24)25/h3-10,12H,11H2,1-2H3,(H,20,21,22)