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

Systemtic Name: [(3S)-1,1-bis(oxidanylidene)thiolan-3-yl] 2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanylethanoate Openeye Name: [(3S)-1,1-dioxothiolan-3-yl] 2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]acetic acid [(3S)-1,1-dioxo-3-thiolanyl] ester IUPAC Name: [(3S)-1,1-dioxothiolan-3-yl] 2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]acetic acid [(3S)-1,1-diketothiolan-3-yl] ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)OC3CCS(=O)(=O)C3

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)O[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C17H20N2O5S2/c1-11(2)19-16(21)13-5-3-4-6-14(13)18-17(19)25-9-15(20)24-12-7-8-26(22,23)10-12/h3-6,11-12H,7-10H2,1-2H3/t12-/m0/s1