[2-[(E)-2-(4-methoxyphenyl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]oxy benzenesulfinate

Systemtic Name: [2-[(E)-2-(4-methoxyphenyl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]oxy benzenesulfinate Openeye Name: [2-[(E)-2-(4-methoxyphenyl)vinyl]-4-oxo-quinazolin-3-yl]oxy benzenesulfinate CAS Name: benzenesulfinic acid [2-[(E)-2-(4-methoxyphenyl)ethenyl]-4-oxo-3-quinazolinyl]oxy ester IUPAC Name: [2-[(E)-2-(4-methoxyphenyl)ethenyl]-4-oxoquinazolin-3-yl]oxy benzenesulfinate Traditional Name: benzenesulfinic acid [4-keto-2-[(E)-2-(4-methoxyphenyl)vinyl]quinazolin-3-yl]oxy ester Formula: C23H18N2O5S MolecularWeight: 434.46442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC2=NC3=CC=CC=C3C(=O)N2OOS(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C2=NC3=CC=CC=C3C(=O)N2OOS(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H18N2O5S/c1-28-18-14-11-17(12-15-18)13-16-22-24-21-10-6-5-9-20(21)23(26)25(22)29-30-31(27)19-7-3-2-4-8-19/h2-16H,1H3/b16-13+