2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoic acid Openeye Name: 2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanylacetic acid CAS Name: 2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]acetic acid IUPAC Name: 2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetic acid Traditional Name: 2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]acetic acid Formula: C12H12N2O3S MolecularWeight: 264.30028

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)O

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)O

InChI

InChI=1S/C12H12N2O3S/c1-2-14-11(17)8-5-3-4-6-9(8)13-12(14)18-7-10(15)16/h3-6H,2,7H2,1H3,(H,15,16)