[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl] 2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: [(3S)-1,1-bis(oxidanylidene)thiolan-3-yl] 2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoate Openeye Name: [(3S)-1,1-dioxothiolan-3-yl] 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetic acid [(3S)-1,1-dioxo-3-thiolanyl] ester IUPAC Name: [(3S)-1,1-dioxothiolan-3-yl] 2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetic acid [(3S)-1,1-diketothiolan-3-yl] ester Formula: C17H18N2O5S2 MolecularWeight: 394.46522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)OC3CCS(=O)(=O)C3

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)O[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C17H18N2O5S2/c1-2-8-19-16(21)13-5-3-4-6-14(13)18-17(19)25-10-15(20)24-12-7-9-26(22,23)11-12/h2-6,12H,1,7-11H2/t12-/m0/s1