2-(7-methoxycarbonyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanoic acid

Systemtic Name: 2-(7-methoxycarbonyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanoic acid Openeye Name: 2-(7-methoxycarbonyl-4-oxo-2-thioxo-1H-quinazolin-3-yl)acetic acid CAS Name: 2-(7-methoxycarbonyl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)acetic acid IUPAC Name: 2-(7-methoxycarbonyl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)acetic acid Traditional Name: 2-(7-carbomethoxy-4-keto-2-thioxo-1H-quinazolin-3-yl)acetic acid Formula: C12H10N2O5S MolecularWeight: 294.2832

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC(=O)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC(=O)O

InChI

InChI=1S/C12H10N2O5S/c1-19-11(18)6-2-3-7-8(4-6)13-12(20)14(10(7)17)5-9(15)16/h2-4H,5H2,1H3,(H,13,20)(H,15,16)