[2-acetyloxy-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propyl] ethanoate

Systemtic Name: [2-acetyloxy-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propyl] ethanoate Openeye Name: [2-acetoxy-3-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-propyl] acetate CAS Name: acetic acid [2-acetyloxy-3-[(4-oxo-3-phenyl-2-quinazolinyl)thio]propyl] ester IUPAC Name: [2-acetyloxy-3-(4-oxo-3-phenylquinazolin-2-yl)sulfanylpropyl] acetate Traditional Name: acetic acid [2-acetoxy-3-[(4-keto-3-phenyl-quinazolin-2-yl)thio]propyl] ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3)OC(=O)C

Isomeric SMILES

CC(=O)OCC(CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3)OC(=O)C

InChI

InChI=1S/C21H20N2O5S/c1-14(24)27-12-17(28-15(2)25)13-29-21-22-19-11-7-6-10-18(19)20(26)23(21)16-8-4-3-5-9-16/h3-11,17H,12-13H2,1-2H3