[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-(butylsulfonylamino)propanoate

Systemtic Name: [3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-(butylsulfonylamino)propanoate Openeye Name: [3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]methyl 2-(butylsulfonylamino)propanoate CAS Name: 2-(butylsulfonylamino)propanoic acid [3-(4-fluorophenyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]methyl 2-(butylsulfonylamino)propanoate Traditional Name: 2-(butylsulfonylamino)propionic acid [3-(4-fluorophenyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C22H24FN3O5S MolecularWeight: 461.506463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(C)C(=O)OCC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)F

Isomeric SMILES

CCCCS(=O)(=O)NC(C)C(=O)OCC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FN3O5S/c1-3-4-13-32(29,30)25-15(2)22(28)31-14-20-24-19-8-6-5-7-18(19)21(27)26(20)17-11-9-16(23)10-12-17/h5-12,15,25H,3-4,13-14H2,1-2H3