phenyl 2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanesulfonate

Systemtic Name: phenyl 2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanesulfonate Openeye Name: phenyl 2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylethanesulfonate CAS Name: 2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylethanesulfonate Traditional Name: 2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]ethanesulfonic acid phenyl ester Formula: C22H18N2O4S2 MolecularWeight: 438.51932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCS(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCS(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C22H18N2O4S2/c25-21-19-13-7-8-14-20(19)23-22(24(21)17-9-3-1-4-10-17)29-15-16-30(26,27)28-18-11-5-2-6-12-18/h1-14H,15-16H2