2,4-bis(oxidanylidene)-3-(2-sulfanylethyl)-1H-quinazoline-7-carboxylate

Systemtic Name: 2,4-bis(oxidanylidene)-3-(2-sulfanylethyl)-1H-quinazoline-7-carboxylate Openeye Name: 2,4-dioxo-3-(2-sulfanylethyl)-1H-quinazoline-7-carboxylate CAS Name: 3-(2-mercaptoethyl)-2,4-dioxo-1H-quinazoline-7-carboxylate IUPAC Name: 2,4-dioxo-3-(2-sulfanylethyl)-1H-quinazoline-7-carboxylate Traditional Name: 2,4-diketo-3-(2-mercaptoethyl)-1H-quinazoline-7-carboxylate Formula: C11H9N2O4S- MolecularWeight: 265.26516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)[O-])NC(=O)N(C2=O)CCS

Isomeric SMILES

C1=CC2=C(C=C1C(=O)[O-])NC(=O)N(C2=O)CCS

InChI

InChI=1S/C11H10N2O4S/c14-9-7-2-1-6(10(15)16)5-8(7)12-11(17)13(9)3-4-18/h1-2,5,18H,3-4H2,(H,12,17)(H,15,16)/p-1