2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: 2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoate Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetate IUPAC Name: 2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetate Formula: C13H11N2O3S- MolecularWeight: 275.30304

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)[O-]

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)[O-]

InChI

InChI=1S/C13H12N2O3S/c1-2-7-15-12(18)9-5-3-4-6-10(9)14-13(15)19-8-11(16)17/h2-6H,1,7-8H2,(H,16,17)/p-1