[(3S,4S,5R,6S)-4,5-diacetyloxy-6-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-oxan-3-yl] ethanoate

Systemtic Name: [(3S,4S,5R,6S)-4,5-diacetyloxy-6-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-oxan-3-yl] ethanoate Openeye Name: [(3S,4S,5R,6S)-4,5-diacetoxy-6-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(3S,4S,5R,6S)-4,5-diacetyloxy-6-[(4-oxo-3-phenyl-2-quinazolinyl)thio]-3-oxanyl] ester IUPAC Name: [(3S,4S,5R,6S)-4,5-diacetyloxy-6-(4-oxo-3-phenylquinazolin-2-yl)sulfanyloxan-3-yl] acetate Traditional Name: acetic acid [(3S,4S,5R,6S)-4,5-diacetoxy-6-[(4-keto-3-phenyl-quinazolin-2-yl)thio]tetrahydropyran-3-yl] ester Formula: C25H24N2O8S MolecularWeight: 512.53166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CC(=O)O[C@H]1CO[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C25H24N2O8S/c1-14(28)33-20-13-32-24(22(35-16(3)30)21(20)34-15(2)29)36-25-26-19-12-8-7-11-18(19)23(31)27(25)17-9-5-4-6-10-17/h4-12,20-22,24H,13H2,1-3H3/t20-,21-,22+,24-/m0/s1