[3,4,5-triacetyloxy-6-(4-oxidanylidene-3-phenyl-2-sulfanylidene-quinazolin-1-yl)oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-(4-oxidanylidene-3-phenyl-2-sulfanylidene-quinazolin-1-yl)oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-(4-oxo-3-phenyl-2-thioxo-quinazolin-1-yl)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-(4-oxo-3-phenyl-2-sulfanylidene-1-quinazolinyl)-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-(4-oxo-3-phenyl-2-sulfanylidenequinazolin-1-yl)oxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-(4-keto-3-phenyl-2-thioxo-quinazolin-1-yl)tetrahydropyran-2-yl]methyl ester Formula: C28H28N2O10S MolecularWeight: 584.59432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)N2C3=CC=CC=C3C(=O)N(C2=S)C4=CC=CC=C4)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)N2C3=CC=CC=C3C(=O)N(C2=S)C4=CC=CC=C4)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C28H28N2O10S/c1-15(31)36-14-22-23(37-16(2)32)24(38-17(3)33)25(39-18(4)34)27(40-22)30-21-13-9-8-12-20(21)26(35)29(28(30)41)19-10-6-5-7-11-19/h5-13,22-25,27H,14H2,1-4H3